SCHEMBL5555023

SCHEMBL5555023

Cc1nc2c([nH]1)CCCC2=O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.51
KMT2A Q03164 2/20 0.51
HAVCR2 Q8TDQ0 1/20 0.47
PTK2 Q05397 1/20 0.39
TSHR P16473 3/20 0.36
KDM4E B2RXH2 3/20 0.35
CYP1A2 P05177 1/20 0.33
HIF1A Q16665 1/20 0.33
PKN1 Q16512 1/20 0.33
PKN2 Q16513 1/20 0.33
ALDH1A1 P00352 5/20 0.32
PARP1 P09874 2/20 0.32
MEN1 O00255 1/20 0.32
HPGD P15428 1/20 0.32
HSD17B10 Q99714 1/20 0.32
PARP15 Q460N3 1/20 0.32
PARP3 Q9Y6F1 1/20 0.32
MAPT P10636 2/20 0.31
NPC1 O15118 1/20 0.30
LMNA P02545 1/20 0.30

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
SCHEMBL9077277 0.96 L3MBTL1 (0.47) L3MBTL1KMT2AHAVCR2PTK2TSHR
SCHEMBL8265453 0.76 ALDH1A1 (0.41) L3MBTL1KMT2AHAVCR2KDM4ECYP1A2
SCHEMBL2502652 0.76 L3MBTL1 (0.47) L3MBTL1KMT2APTK2TSHRKDM4E
SCHEMBL21663010 0.76 L3MBTL1 (0.47) L3MBTL1KMT2APTK2TSHRPKN1
SCHEMBL2475108 0.76 L3MBTL1 (0.47) L3MBTL1KMT2APTK2TSHRPKN1
SCHEMBL2513496 0.72 L3MBTL1 (0.44) L3MBTL1KMT2ATSHRMAPTLMNA
SCHEMBL2510671 0.72 KMT2A (0.44) L3MBTL1KMT2ATSHRKDM4E
SCHEMBL2756447 0.70
SCHEMBL4773286 0.69 KMT2A (0.42) L3MBTL1KMT2AKDM4EHIF1AALDH1A1
SCHEMBL19153079 0.68 KDM4E (0.43) KMT2AHAVCR2TSHRKDM4ECYP1A2

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11168088-B2 Pyridylamino substituted heterotricyclic compounds, and preparation method and pharmaceutical use thereof SHANGHAI HAIYAN PHARMACEUTICAL TECHNOLOGY CO., LTD. 2021-11-09 US disclosed
US-20200039983-A1 PYRIDYLAMINO SUBSTITUTED HETEROTRICYCLIC COMPOUNDS, AND PREPARATION METHOD AND PHARMACEUTICAL USE THEREOF SHANGHAI HAIYAN PHARMACEUTICAL TECHNOLOGY CO., LTD. (CN) 2020-02-06 US disclosed
US-20170202970-A1 SILICON BASED DRUG CONJUGATES AND METHODS OF USING SAME BLINKBIO, INC. 2017-07-20 US disclosed
US-20070244173-A1 6,7-Dihydroxy-8-Phenyl-3,6,7,8-Tetrahydro-Chromeno [7,8-d] Imidazole Derivatives and Their Use as Gastric Acid Secretion Inhibitors ALTANA PHARMA AG (DE) 2007-10-18 US disclosed
US-20070037840-A1 Tricyclic benzimidazoles ALTANA PHARMA AG (DE) 2007-02-15 US disclosed
EP-1742951-A1 6,7-DIHYDROXY-8-PHENYL-3,6,7,8-TETRAHYDRO-CHROMENO[7, 8-D]IMIDAZOLE DERIVATIVES AND THEIR USE AS GASTRIC ACID SECRETION INHIBITORS Altana Pharma AG (DE) 2007-01-17 EP disclosed
EP-1697357-A2 TRICYCLIC BENZIMIDAZOLES Altana Pharma AG (DE) 2006-09-06 EP disclosed
WO-2005103057-A1 6,7-DIHYDROXY-8-PHENYL-3,6,7,8-TETRAHYDRO-CHROMENO[7, 8-D]IMIDAZOLE DERIVATIVES AND THEIR USE AS GASTRIC ACID SECRETION INHIBITORS ALTANA PHARMA AG (DE) 2005-11-03 WO disclosed
WO-2005058893-A1 TRICYCLIC BENZIMIDAZOLES ALTANA PHARMA AG (DE) 2005-06-30 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 (5 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-20170202970-A1 SILICON BASED DRUG CONJUGATES AND METHODS OF USING SAME CD44, MSN, AS3MT L3MBTL1 669/4885KMT2A 1005/4885HAVCR2 382/4885
US-20070244173-A1 6,7-Dihydroxy-8-Phenyl-3,6,7,8-Tetrahydro-Chromeno [7,8-d] Imidazole Derivatives and Their Use as Gastric Acid Secretion Inhibitors GIPR, CYP7A1, PGC L3MBTL1 4735/4885KMT2A 3899/4885HAVCR2 4379/4885
US-20070037840-A1 Tricyclic benzimidazoles VIP, GIPR, PGC L3MBTL1 2465/4885KMT2A 3413/4885HAVCR2 4549/4885
US-11168088-B2 Pyridylamino substituted heterotricyclic compounds, and preparation method and pharmaceutical use thereof CYP2D6, PNPO, CYP2B6 L3MBTL1 4827/4885KMT2A 2962/4885HAVCR2 3247/4885
US-20200039983-A1 PYRIDYLAMINO SUBSTITUTED HETEROTRICYCLIC COMPOUNDS, AND PREPARATION METHOD AND PHARMACEUTICAL USE THEREOF CYP2D6, PNPO, CYP2B6 L3MBTL1 4827/4885KMT2A 2962/4885HAVCR2 3247/4885

“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.