SCHEMBL31607907

SCHEMBL31607907

CC(C)(C)[Si](C)(C)OCC#Cc1ccc(N)nc1

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 1/20 0.38
▸ CYP2E1 P05181 1/20 0.38
▸ CYP2A6 P11509 1/20 0.38
▸ CYP2B6 P20813 1/20 0.38
▸ CYP2C19 P33261 1/20 0.38
▸ MTOR P42345 18/20 0.37
▸ PIK3CA P42336 15/20 0.36
▸ DRD2 P14416 1/20 0.36
▸ DRD4 P21917 1/20 0.36
▸ DRD3 P35462 1/20 0.36

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
SCHEMBL617257 0.78 ALOX5AP (0.35) —
SCHEMBL15929576 0.77 MTOR (0.35) CYP1A2CYP2E1CYP2A6CYP2B6CYP2C19
SCHEMBL8526099 0.75 CYP1A2 (0.41) CYP1A2CYP2C19DRD2
SCHEMBL15307380 0.74 ALK (0.35) —
SCHEMBL20208683 0.74 CYP1A2 (0.43) CYP1A2CYP2C19
SCHEMBL20973025 0.72 — —
SCHEMBL19584510 0.71 GRM5 (0.39) —
SCHEMBL14720794 0.71 EGLN1 (0.40) —
SCHEMBL30423197 0.71 GABRP (0.41) —
SCHEMBL643187 0.71 GABRP (0.41) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120092003-A CDK protein degrading agents, pharmaceutical compositions and therapeutic uses 拜欧斯瑞克斯公司 2025-06-03 — — CN disclosed
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