SCHEMBL29034623

SCHEMBL29034623

CCOC(=O)N1CCc2c(c3cc(Cl)ccc3n2-c2ccc(Cl)cc2)C1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
BAZ2B Q9UIF8 6/20 0.54
AKR1B10 O60218 1/20 0.52
AKR1B1 P15121 1/20 0.52
PTGDR2 Q9Y5Y4 2/20 0.47
LMNA P02545 2/20 0.43
PABPC1 P11940 1/20 0.43
ATM Q13315 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
PTGER2 P43116 1/20 0.43
PTGDR Q13258 1/20 0.43
MAPK1 P28482 2/20 0.41
MAPT P10636 1/20 0.41
HTT P42858 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41

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
SCHEMBL11759394 0.90 BAZ2B (0.46) BAZ2BAKR1B10AKR1B1PTGDR2LMNA
SCHEMBL10773567 0.85 AKR1B10 (0.52) AKR1B10AKR1B1PTGDR2
SCHEMBL29034617 0.84 AKR1B10 (0.70) AKR1B10AKR1B1PTGDR2LMNAPABPC1
SCHEMBL5315252 0.81 BAZ2B (0.48) BAZ2BAKR1B10AKR1B1PTGDR2LMNA
SCHEMBL28603644 0.81 BAZ2B (0.51) BAZ2BPTGDR2PTGER2PTGDR
SCHEMBL28606447 0.79 PTGDR2 (0.56) BAZ2BPTGDR2LMNAPTGER2PTGDR
SCHEMBL13242303 0.77 HDAC1 (0.50) BAZ2B
SCHEMBL5319936 0.76 PTGDR2 (0.53) BAZ2BAKR1B10AKR1B1PTGDR2LMNA
SCHEMBL11670078 0.75 AKR1B10 (0.43) AKR1B10AKR1B1SMN1; SMN2
SCHEMBL5316996 0.74 TP53 (0.53) BAZ2BAKR1B10AKR1B1PTGDR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116425670-A Novel heterocyclic compounds as TEAD inhibitors 英矽智能科技(上海)有限公司 2023-07-14 CN claimed
CN-116425670-A Novel heterocyclic compounds as TEAD inhibitors 英矽智能科技(上海)有限公司 2023-07-14 CN disclosed