SCHEMBL32679538

SCHEMBL32679538

O=Cc1ccc(Nc2ccnc(N3CCN(C4COC4)CC3)n2)cc1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CCNE1 P24864 7/20 0.43
▸ CDK2 P24941 7/20 0.43
▸ ROCK2 O75116 9/20 0.41
▸ ROCK1 Q13464 3/20 0.41
▸ ACHE P22303 2/20 0.41
▸ HSP90AA1 P07900 2/20 0.39
▸ HSP90AB1 P08238 2/20 0.39
▸ CDK4 P11802 1/20 0.38
▸ CCND1 P24385 1/20 0.38
▸ CCND3 P30281 1/20 0.38
▸ CDK7 P50613 1/20 0.38
▸ CCNH P51946 1/20 0.38
▸ MNAT1 P51948 1/20 0.38
▸ CDK6 Q00534 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
SCHEMBL32679532 0.84 CCNE1 (0.49) CCNE1CDK2ROCK2ROCK1ACHE
SCHEMBL15344975 0.71 SORD (0.48) —
SCHEMBL15749181 0.70 EGFR (0.69) CDK2
SCHEMBL17661179 0.68 TBK1 (0.51) ROCK2
SCHEMBL15341857 0.68 SORD (0.41) ACHE
SCHEMBL26106026 0.65 ACHE (0.47) CCNE1CDK2ROCK2ROCK1ACHE
SCHEMBL15698538 0.65 CCNE1 (0.61) CCNE1CDK2ROCK2ROCK1ACHE
SCHEMBL25630336 0.65 MAPK8 (0.52) CCNE1CDK2ROCK2ROCK1ACHE
SCHEMBL30682482 0.65 DPP4 (0.36) —
SCHEMBL19957592 0.63 ACHE (0.47) ROCK2ACHE

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-120647626-B 4-Aminopyrimidine compound targeting EGFR and AXL targets as well as preparation method and application thereof 江西省肿瘤医院(江西省第二人民医院、江西省癌症中心) 2026-02-27 — — CN disclosed
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