SCHEMBL30754455

SCHEMBL30754455

Cc1cc2c(ccc(=O)n2C)cn1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRPF1 P55201 9/20 0.47
BRD4 O60885 3/20 0.47
BRD9 Q9H8M2 3/20 0.47
CA12 O43570 1/20 0.47
CA9 Q16790 1/20 0.47
KAT2B Q92831 1/20 0.47
BTK Q06187 1/20 0.43
CYP1A2 P05177 1/20 0.41
CYP2A6 P11509 1/20 0.41
CDK4 P11802 1/20 0.40
CCND1 P24385 1/20 0.40
CCND2 P30279 1/20 0.40
CCND3 P30281 1/20 0.40
KDM4E B2RXH2 1/20 0.36
NQO2 P16083 1/20 0.36
BRD1 O95696 3/20 0.35
BRPF3 Q9ULD4 2/20 0.35
BCL6 P41182 1/20 0.34
IL5 P05113 1/20 0.34
FGFR1 P11362 1/20 0.34

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
SCHEMBL22538172 0.79 BTK (0.64) BTKCYP1A2CYP2A6CDK4CCND1
SCHEMBL19508035 0.75 BRPF1 (0.47) BRPF1BRD4BRD9CYP1A2CYP2A6
SCHEMBL2361093 0.74 BTK (0.49) BRPF1BRD4BRD9CA12CA9
SCHEMBL28311122 0.73 BRPF1 (0.56) BRPF1BRD4BRD9CA12CA9
SCHEMBL1119899 0.73 BRPF1 (0.59) BRPF1BRD4BRD9CA12CA9
SCHEMBL35211518 0.73 BRPF1 (0.53) BRPF1BRD4BRD9CA12CA9
SCHEMBL1356214 0.73 BRPF1 (0.53) BRPF1BRD4BRD9CA12CA9
SCHEMBL7926055 0.72 PIK3CB (0.50) CYP1A2CYP2A6MAPK1
SCHEMBL17813481 0.71 KMO (0.44) BTKCYP1A2CYP2A6KDM4E
SCHEMBL6642011 0.70 CDK4 (0.47) BRPF1BTKCDK4CCND1CCND2

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-119451960-A Fused ring compound, preparation method and application thereof 上海艾力斯医药科技股份有限公司 2025-02-14 CN disclosed
WO-2024027762-A1 FUSED RING COMPOUND, AND PREPARATION METHOD THEREFOR AND USE THEREOF 上海艾力斯医药科技股份有限公司 2024-02-08 WO disclosed