SCHEMBL4119052

SCHEMBL4119052

CC1(C)OB(c2cnccc2C#N)OC1(C)C

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.37
KMT2A Q03164 2/20 0.36
MEN1 O00255 1/20 0.36
LATS1 O95835 1/20 0.34
LATS2 Q9NRM7 1/20 0.34
NCOA3 Q9Y6Q9 1/20 0.34
ESR2 Q92731 1/20 0.33
LPL P06858 3/20 0.32
LIPG Q9Y5X9 3/20 0.32
CCNT1 O60563 1/20 0.31
CDK9 P50750 1/20 0.31
HASPIN Q8TF76 1/20 0.31
ALDH1A1 P00352 2/20 0.31
GPR119 Q8TDV5 2/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
CHRNB2 P17787 1/20 0.31
CHRNA7 P36544 1/20 0.31
CHRNA4 P43681 1/20 0.31
KDM4E B2RXH2 1/20 0.31
LMNA P02545 1/20 0.31

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
SCHEMBL29572040 1.00 HTT (0.37) HTTKMT2AMEN1LATS1LATS2
SCHEMBL9936199 0.90 HTT (0.37) HTTKMT2AMEN1LATS1LATS2
SCHEMBL29768444 0.90 HTT (0.37) HTTKMT2AMEN1LATS1LATS2
SCHEMBL2187689 0.80 LATS1 (0.35) HTTKMT2AMEN1LATS1LATS2
SCHEMBL27191758 0.78 ESR2 (0.31) ESR2
SCHEMBL31663361 0.78 ESR2 (0.31) ESR2
SCHEMBL29515710 0.77 LPL (0.34) LPLLIPGCYP2E1CYP2C8CYP2D6
SCHEMBL2352761 0.77 LPL (0.34) LPLLIPGCYP2E1CYP2C8CYP2D6
SCHEMBL520252 0.77 LPL (0.42) HTTESR2LPLLIPGALDH1A1
SCHEMBL30107439 0.77 LPL (0.40) LPLLIPGCYP2E1CYP2C8CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12466815-B2 Carboxamide compounds and uses thereof INCYTE CORPORATION (US) 2025-11-11 US disclosed
US-12410183-B2 Sars-cov2 main protease inhibitors GILEAD SCIENCES, INC. (US) 2025-09-09 US disclosed
EP-4594318-A1 AKT1 MODULATORS Alterome Therapeutics, Inc. (US) 2025-08-06 EP disclosed
EP-4069697-B1 CRF RECEPTOR ANTAGONISTS AND METHODS OF USE NEUROCRINE BIOSCIENCES INC (US) 2025-07-16 EP disclosed
WO-2025092989-A1 SUBSTITUTED QUINAZOLINE COMPOUND, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMBINATION THEREOF, AND USE THEREOF 泰州红云制药有限公司 2025-05-08 WO disclosed
US-20250122174-A1 Heteroaryl Compounds As HPK1 Inhibitors And Methods Of Using Same SHENZHEN YUANLI SHENWAN INNOVATIVE MEDICINE CO LTD (CN) 2025-04-17 US disclosed
US-20250092040-A1 AKT1 MODULATORS ALTEROME THERAPEUTICS, INC. 2025-03-20 US disclosed
US-20250042915-A1 SARS-COV2 MAIN PROTEASE INHIBITORS GILEAD SCIENCES, INC. 2025-02-06 US disclosed
EP-4463150-A1 HETEROARYL COMPOUNDS AS HPK1 INHIBITORS AND METHODS OF USING SAME Shenzhen Ionova Life Science Co., Ltd. (CN) 2024-11-20 EP disclosed
US-20240368170-A1 CINNOLINE COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2024-11-07 US disclosed
US-8765784-B2 Positive allosteric modulators of MGLUR2 MERCK SHARP & DOHME CORP. (US) 2014-07-01 US disclosed
US-8765784-B2 Positive allosteric modulators of MGLUR2 MERCK SHARP & DOHME CORP. (US) 2014-07-01 US disclosed
US-20130210768-A1 POSITIVE ALLOSTERIC MODULATORS OF MGLUR2 MERCK SHARP & DOHME LLC 2013-08-15 US disclosed
US-20130210768-A1 POSITIVE ALLOSTERIC MODULATORS OF MGLUR2 MERCK SHARP & DOHME LLC 2013-08-15 US disclosed
WO-2011156245-A2 POSITIVE ALLOSTERIC MODULATORS OF MGLUR2 MERCK SHARP & DOHME CORP. (US) 2011-12-15 WO disclosed
US-20090233943-A9 NEW COMPOUNDS 835 ASTEX THERAPEUTICS LIMITED (GB) 2009-09-17 US disclosed
WO-2008150217-A1 2-AMINO-5, 5-DIARYL-IMIDAZOL-4-ONE ANALOGS FOR THE INHIBITION OF BETA-SECRETASE ASTRAZENECA AB (SE) 2008-12-11 WO disclosed
US-20080287460-A1 NEW COMPOUNDS 835 ASTEX THERAPEUTICS LIMITED (GB) 2008-11-20 US disclosed
US-20080161269-A1 Compounds 620 ASTRAZENECA AB (SE) 2008-07-03 US disclosed
WO-2008076045-A1 NOVEL 2-AMINO- 5-ARYL-IMIDAZOL-4 -ONES ASTRAZENECA AB (SE) 2008-06-26 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 (10 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-20080161269-A1 Compounds 620 MAPT, PSEN1, PSEN2 HTT 32/4885KMT2A 3211/4885MEN1 3173/4885
US-20080287460-A1 NEW COMPOUNDS 835 GRIK5, MAPT, PSEN1 HTT 41/4885KMT2A 2568/4885MEN1 2937/4885
US-20250042915-A1 SARS-COV2 MAIN PROTEASE INHIBITORS ACE2, TMPRSS2, ACE HTT 3577/4885KMT2A 3085/4885MEN1 3914/4885
US-20240368170-A1 CINNOLINE COMPOUNDS AND USES THEREOF HIPK1, CDC7, MAP3K7 HTT 2964/4885KMT2A 2199/4885MEN1 313/4885
US-20130210768-A1 POSITIVE ALLOSTERIC MODULATORS OF MGLUR2 GRM2, GRM1, GRIA2 HTT 583/4885KMT2A 982/4885MEN1 4803/4885
US-12410183-B2 Sars-cov2 main protease inhibitors ACE2, TMPRSS2, ACE HTT 3577/4885KMT2A 3085/4885MEN1 3914/4885
US-20250122174-A1 Heteroaryl Compounds As HPK1 Inhibitors And Methods Of Using Same SGK1, HYPK, PCK1 HTT 1241/4885KMT2A 2422/4885MEN1 2249/4885
US-20090233943-A9 NEW COMPOUNDS 835 GRIK5, MAPT, PSEN1 HTT 41/4885KMT2A 2568/4885MEN1 2937/4885
US-20250092040-A1 AKT1 MODULATORS AKT1S1, AKT1, AKT2 HTT 860/4885KMT2A 1301/4885MEN1 1284/4885
US-12466815-B2 Carboxamide compounds and uses thereof PCK1, PHKG2, PHKG1 HTT 2370/4885KMT2A 1609/4885MEN1 2274/4885

“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.