SCHEMBL437783

SCHEMBL437783

CCOC(=O)c1cnc2ccccc2c1N

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.67
NPC1 O15118 3/20 0.67
RAB9A P51151 2/20 0.67
MEN1 O00255 2/20 0.62
PKM P14618 1/20 0.62
MAPT P10636 8/20 0.58
ALDH1A1 P00352 6/20 0.58
KDM4E B2RXH2 2/20 0.58
NPSR1 Q6W5P4 1/20 0.58
SMN1; SMN2 Q16637 4/20 0.56
TP53 P04637 2/20 0.56
AURKA O14965 2/20 0.54
AURKB Q96GD4 2/20 0.54
RXFP1 Q9HBX9 1/20 0.53
HSD17B10 Q99714 1/20 0.53
TSHR P16473 2/20 0.51
LMNA P02545 2/20 0.51
MAPK1 P28482 2/20 0.51
ATM Q13315 1/20 0.51
GAA P10253 1/20 0.50

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL15445432 0.85 KMT2A (0.64) KMT2ANPC1RAB9AMEN1PKM
SCHEMBL29366579 0.84 KMT2A (0.63) KMT2ANPC1RAB9AMEN1PKM
SCHEMBL393627 0.84 KMT2A (0.63) KMT2ANPC1RAB9AMEN1PKM
SCHEMBL5777181 0.84 KDM4E (0.49) KMT2ANPC1RAB9AMEN1PKM
SCHEMBL438198 0.83 MAPK1 (0.63) KMT2ANPC1RAB9AMEN1MAPT
SCHEMBL776014 0.83 MEN1 (0.67) KMT2ANPC1RAB9AMEN1PKM
SCHEMBL31312808 0.83 KMT2A (0.62) KMT2ANPC1RAB9AMEN1PKM
SCHEMBL20494881 0.83 KMT2A (0.62) KMT2ANPC1RAB9AMEN1PKM
SCHEMBL20495354 0.83 KMT2A (0.62) KMT2ANPC1RAB9AMEN1PKM
SCHEMBL5504475 0.83 KMT2A (0.62) KMT2ANPC1RAB9AMEN1PKM

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 40 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10568888-B2 Tricyclic compounds as modulators of TNF-alpha synthesis and as PDE4 inhibitors VTV THERAPEUTICS LLC (US) 2020-02-25 US disclosed
US-20190336506-A1 TRICYCLIC COMPOUNDS AS MODULATORS OF TNF-ALPHA SYNTHESIS AND AS PDE4 INHIBITORS HIGH POINT PHARMACEUTICALS, LLC 2019-11-07 US disclosed
US-10391097-B2 Tricyclic compounds as modulators of TNF-alpha synthesis and as PDE4 inhibitors VTV THERAPEUTICS LLC (US) 2019-08-27 US disclosed
US-20180360839-A1 TRICYCLIC COMPOUNDS AS MODULATORS OF TNF-ALPHA SYNTHESIS AND AS PDE4 INHIBITORS TRANSTECH PHARMA, INC. 2018-12-20 US disclosed
US-10085990-B2 Tricyclic compounds as modulators of TNF-α synthesis and as PDE4 inhibitors VTV THERAPEUTICS LLC (US) 2018-10-02 US disclosed
US-20180071297-A1 TRICYCLIC COMPOUNDS AS MODULATORS OF TNF-ALPHA SYNTHESIS AND AS PDE4 INHIBITORS VTV THERAPEUTICS LLC 2018-03-15 US disclosed
US-9833457-B2 Tricyclic compounds as modulators of TNF-α synthesis and as PDE4 inhibitors VTV THERAPEUTICS LLC (US) 2017-12-05 US disclosed
US-20170252343-A1 TRICYCLIC COMPOUNDS AS MODULATORS OF TNF-ALPHA SYNTHESIS AND AS PDE4 INHIBITORS VTV THERAPEUTICS LLC 2017-09-07 US disclosed
US-9687489-B2 Tricyclic compounds as modulators of TNF-α synthesis and as PDE4 inhibitors VTV THERAPEUTICS LLC (US) 2017-06-27 US disclosed
US-20160296526-A1 TRICYCLIC COMPOUNDS AS MODULATORS OF TNF-ALPHA SYNTHESIS AND AS PDE4 INHIBITORS VTV THERAPEUTICS LLC 2016-10-13 US disclosed
EP-1753724-A1 HETEROCYCLIC DERIVATIVES FOR TREATMENT OF HYPERLIPIDEMIA AND RELATED DISEASES AVANIR PHARMACEUTICALS (US) 2007-02-21 EP disclosed
US-7173042-B2 Quinoline inhibitors of cGMP phosphodiesterase BRISTOL-MYERS SQUIBB COMPANY (US) 2007-02-06 US disclosed
US-20060009487-A1 Heterocyclic derivatives for treatment of hyperlipidemia and related diseases SIRCAR JAGADISH C 2006-01-12 US disclosed
WO-2005123686-A1 HETEROCYCLIC DERIVATIVES FOR TREATMENT OF HYPERLIPIDEMIA AND RELATED DISEASES AVANIR PHARMACEUTICALS (US) 2005-12-29 WO disclosed
US-20050113358-A1 Quinoline inhibitors of cGMP phosphodiesterase BI YINGZHI (US) 2005-05-26 US disclosed
US-6835737-B2 For treating conditions such as erectile dysfunction, cardiovascular disorders, male or female sexual dysfunction, diabetes mellitus, and gastrointestinal disorders BRISTOL-MYERS SQUIBB COMPANY 2004-12-28 US disclosed
US-20030225128-A1 Quinoline inhibitors of cGMP phosphodiesterase BI YINGZHI (US) 2003-12-04 US disclosed
US-6576644-B2 Treating sexual dysfunction including erectile dysfunction, diabetes melitus, gastrointestinal disorders, including gastric paresis and cardiovascular disorders; cyclic guanosine 3',5'-monophosphate (cGMP) BRISTOL-MYERS SQUIBB CO. 2003-06-10 US disclosed
US-20020177587-A1 Quinoline inhibitors of cGMP phosphodiesterase BRISTOL-MYERS SQUIBB COMPANY 2002-11-28 US disclosed
WO-2002020489-A2 QUINOLINE INHIBITORS OF cGMP PHOSPHODIESTERASE BRISTOL-MYERS SQUIBB COMPANY (US) 2002-03-14 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (12 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20190336506-A1 TRICYCLIC COMPOUNDS AS MODULATORS OF TNF-ALPHA SYNTHESIS AND AS PDE4 INHIBITORS PDE4A, PDE4B, TNF KMT2A 3800/4885NPC1 2472/4885RAB9A 2898/4885
US-20180360839-A1 TRICYCLIC COMPOUNDS AS MODULATORS OF TNF-ALPHA SYNTHESIS AND AS PDE4 INHIBITORS PDE4A, PDE4B, PDE4C KMT2A 4100/4885NPC1 4420/4885RAB9A 3074/4885
US-10568888-B2 Tricyclic compounds as modulators of TNF-alpha synthesis and as PDE4 inhibitors PDE4A, PDE4B, TNF KMT2A 3800/4885NPC1 2472/4885RAB9A 2898/4885
US-20050113358-A1 Quinoline inhibitors of cGMP phosphodiesterase PDE5A, PDE3A, PDE2A KMT2A 3474/4885NPC1 3126/4885RAB9A 1217/4885
US-20030225128-A1 Quinoline inhibitors of cGMP phosphodiesterase PDE5A, PDE3A, PDE2A KMT2A 3948/4885NPC1 2662/4885RAB9A 1578/4885
US-20060009487-A1 Heterocyclic derivatives for treatment of hyperlipidemia and related diseases LDLR, NPC1L1, CETP KMT2A 3106/4885NPC1 4/4885RAB9A 1448/4885
US-20180071297-A1 TRICYCLIC COMPOUNDS AS MODULATORS OF TNF-ALPHA SYNTHESIS AND AS PDE4 INHIBITORS PDE4A, PDE4B, PDE4C KMT2A 4100/4885NPC1 4420/4885RAB9A 3074/4885
US-10085990-B2 Tricyclic compounds as modulators of TNF-α synthesis and as PDE4 inhibitors PDE4A, TNF, PDE4B KMT2A 4098/4885NPC1 4331/4885RAB9A 2933/4885
US-20020177587-A1 Quinoline inhibitors of cGMP phosphodiesterase PDE5A, PDE2A, PDE3A KMT2A 2732/4885NPC1 3109/4885RAB9A 1093/4885
US-10391097-B2 Tricyclic compounds as modulators of TNF-alpha synthesis and as PDE4 inhibitors PDE4A, PDE4B, PDE4C KMT2A 4100/4885NPC1 4420/4885RAB9A 3074/4885
US-20170252343-A1 TRICYCLIC COMPOUNDS AS MODULATORS OF TNF-ALPHA SYNTHESIS AND AS PDE4 INHIBITORS TNF, PDE4A, PDE4B KMT2A 4012/4885NPC1 4063/4885RAB9A 3240/4885
US-20160296526-A1 TRICYCLIC COMPOUNDS AS MODULATORS OF TNF-ALPHA SYNTHESIS AND AS PDE4 INHIBITORS PDE4A, TNF, PDE4B KMT2A 3952/4885NPC1 3922/4885RAB9A 3416/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.