SCHEMBL30913580

SCHEMBL30913580

Cc1c(NC(=O)c2cnn(C(C)(C)C)c2)cc(F)cc1-c1ccnc(Cl)n1

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ BTK Q06187 11/20 0.40
▸ GRM5 P41594 2/20 0.36
▸ RPS6KA2 Q15349 1/20 0.36
▸ NTRK1 P04629 1/20 0.35
▸ AR P10275 1/20 0.35
▸ KDM1A O60341 1/20 0.35
▸ BUB1 O43683 2/20 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
SCHEMBL25170617 1.00 BTK (0.40) BTKGRM5RPS6KA2NTRK1AR
SCHEMBL25170630 0.85 BTK (0.37) BTKGRM5
SCHEMBL30913575 0.85 BTK (0.37) BTKGRM5
SCHEMBL25173924 0.72 BTK (0.52) BTK
SCHEMBL25170785 0.70 LIPE (0.38) KDM1ABUB1
SCHEMBL16794185 0.70 BTK (0.44) BTK
SCHEMBL20054059 0.70 BTK (0.40) BTK
SCHEMBL30434223 0.68 BTK (0.49) BTK
SCHEMBL25169911 0.68 BTK (0.49) BTK
SCHEMBL25983517 0.66 ABL1 (0.47) BUB1

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-118159532-A Compound with BTK protein degradation activity and medical application thereof 尤比克斯治疗公司 2024-06-07 — — CN disclosed
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