SCHEMBL8222771

SCHEMBL8222771

CC(C)Cc1ccc2c(cnn2C)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTNNB1 P35222 1/20 0.51
TCF7 P36402 1/20 0.51
MPO P05164 1/20 0.45
CCNC P24863 1/20 0.42
HTR2A P28223 1/20 0.42
CDK8 P49336 1/20 0.42
PASK Q96RG2 1/20 0.42
CDK19 Q9BWU1 1/20 0.42
TRPM5 Q9NZQ8 1/20 0.42
CACNA1H O95180 7/20 0.41
DRD4 P21917 3/20 0.41
SIGMAR1 Q99720 3/20 0.41
TMEM97 Q5BJF2 2/20 0.41
TRPA1 O75762 1/20 0.40
CACNA1G O43497 3/20 0.39
CACNA1I Q9P0X4 3/20 0.39
CDC7 O00311 1/20 0.39
GABRA1 P14867 1/20 0.39
GABRB2 P47870 1/20 0.39
VNN1 O95497 1/20 0.38

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
SCHEMBL8253677 0.88 MPO (0.44) CTNNB1TCF7MPOCCNCHTR2A
SCHEMBL23425546 0.82 HDAC8 (0.43) CTNNB1TCF7HTR2ACACNA1HGABRA1
SCHEMBL8179108 0.81 CTNNB1 (0.55) CTNNB1TCF7MPOCCNCHTR2A
SCHEMBL29491495 0.79 CTNNB1 (0.54) CTNNB1TCF7MPOCCNCHTR2A
SCHEMBL904751 0.79 CTNNB1 (0.54) CTNNB1TCF7MPOCCNCHTR2A
SCHEMBL21770459 0.79 CTNNB1 (0.54) CTNNB1TCF7MPOCCNCHTR2A
SCHEMBL15333416 0.79 CTNNB1 (0.54) CTNNB1TCF7MPOCCNCHTR2A
SCHEMBL1665815 0.79 CTNNB1 (0.54) CTNNB1TCF7MPOCCNCHTR2A
SCHEMBL29728749 0.79 CTNNB1 (0.54) CTNNB1TCF7MPOCCNCHTR2A
SCHEMBL13849994 0.79 CTNNB1 (0.45) CTNNB1TCF7MPOCCNCHTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024059665-A1 DIMERIC COMPOUNDS AS INHIBITORS OF GLYCOGEN SYNTHASE 1 (GYS1) AND METHODS OF USE THEREOF MAZE THERAPEUTICS, INC. (US) 2024-03-21 WO disclosed
US-11814367-B2 Inhibitors of glycogen synthase 1 (GYS1) and methods of use thereof MAZE THERAPEUTICS, INC. (US) 2023-11-14 US disclosed
US-11814367-B2 Inhibitors of glycogen synthase 1 (GYS1) and methods of use thereof MAZE THERAPEUTICS, INC. (US) 2023-11-14 US disclosed
US-11787780-B2 Quaternary indazole glucocorticoid receptor antagonists CORCEPT THERAPEUTICS INCORPORATED (US) 2023-10-17 US disclosed
WO-2022198196-A1 INHIBITORS OF GLYCOGEN SYNTHASE 1 (GYS1) AND METHODS OF USE THEREOF MAZE THERAPEUTICS, INC. (US) 2022-09-22 WO disclosed
US-20200255413-A1 ANTIBACTERIAL COMPOUNDS BLACKSMITH MEDICINES, INC. 2020-08-13 US disclosed
US-10005774-B2 Syk inhibitors GILEAD SCIENCES, INC. (US) 2018-06-26 US disclosed
US-8937077-B2 Bicyclic diamines as janus kinase inhibitors MERCK SHARP & DOHME CORP. (US) 2015-01-20 US disclosed
US-8835441-B2 Heterobicyclic metalloprotease inhibitors AMGEN INC. (US) 2014-09-16 US disclosed
US-20130225577-A1 BICYCLIC DIAMINES AS JANUS KINASE INHIBITORS MERCK SHARP & DOHME LLC 2013-08-29 US disclosed
US-20080021024-A1 Metalloprotease inhibitors ALANTOS PHARMACEUTICALS HOLDING, INC. 2008-01-24 US disclosed
US-20080021024-A1 Metalloprotease inhibitors ALANTOS PHARMACEUTICALS HOLDING, INC. 2008-01-24 US disclosed
WO-2007139860-A2 HETEROBICYLIC METALLOPROTEASE INHIBITORS ALANTOS PHARMACEUTICALS, INC. (US) 2007-12-06 WO disclosed
WO-2007139856-A2 HETEROBICYCLIC METALLOPROTEASE INHIBITORS ALANTOS PHARMACEUTICALS, INC. (US) 2007-12-06 WO disclosed
US-20070155739-A1 Substituted bis-amide metalloprotease inhibitors ALANTOS PHARMACEUTICALS, INC. 2007-07-05 US disclosed
US-20070155738-A1 Heterobicyclic metalloprotease inhibitors ALANTOS PHARMACEUTICALS, INC. 2007-07-05 US disclosed
US-20070155738-A1 Heterobicyclic metalloprotease inhibitors ALANTOS PHARMACEUTICALS, INC. 2007-07-05 US disclosed
US-20070155737-A1 Heterobicyclic metalloprotease inhibitors ALANTOS PHARMACEUTICALS, INC. 2007-07-05 US disclosed
US-20070155737-A1 Heterobicyclic metalloprotease inhibitors ALANTOS PHARMACEUTICALS, INC. 2007-07-05 US disclosed
WO-2006128184-A2 PYRIMIDINE OR TRIAZINE FUSED BICYCLIC METALLOPROTEASE INHIBITORS ALANTOS-PHARMACEUTICALS, INC. (US) 2006-11-30 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 (9 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-11787780-B2 Quaternary indazole glucocorticoid receptor antagonists NR3C1, NR3C2, MC2R CTNNB1 3631/4885TCF7 1986/4885MPO 4543/4885
US-20070155737-A1 Heterobicyclic metalloprotease inhibitors ADAMTS4, ADAMTS1, ADAMTS5 CTNNB1 4050/4885TCF7 4474/4885MPO 2320/4885
US-11814367-B2 Inhibitors of glycogen synthase 1 (GYS1) and methods of use thereof GYS2, GYS1, PYGL CTNNB1 899/4885TCF7 3235/4885MPO 3947/4885
US-20200255413-A1 ANTIBACTERIAL COMPOUNDS SPOUT1, MRPL21, NRDC CTNNB1 3976/4885TCF7 1780/4885MPO 26/4885
US-20130225577-A1 BICYCLIC DIAMINES AS JANUS KINASE INHIBITORS JAK1, JAK2, JAK3 CTNNB1 4501/4885TCF7 2843/4885MPO 368/4885
US-20070155739-A1 Substituted bis-amide metalloprotease inhibitors MMP13, MMP9, ADAMTS13 CTNNB1 2205/4885TCF7 3056/4885MPO 157/4885
US-20080021024-A1 Metalloprotease inhibitors MMP2, MMP9, MMP3 CTNNB1 1322/4885TCF7 1873/4885MPO 92/4885
US-20070155738-A1 Heterobicyclic metalloprotease inhibitors MMP13, TIMP3, MMP3 CTNNB1 3338/4885TCF7 4090/4885MPO 367/4885
US-10005774-B2 Syk inhibitors SYK, BTK, LYN CTNNB1 3052/4885TCF7 2116/4885MPO 818/4885

“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.