SCHEMBL31589695

SCHEMBL31589695

CCn1cc(-c2ccc(OC)cc2)c2cc[nH]c2c1=O

nearest known ligand 0.59

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ BRD4 O60885 9/20 0.59
▸ CECR2 Q9BXF3 5/20 0.55
▸ BRD9 Q9H8M2 7/20 0.53
▸ TAF1 P21675 2/20 0.50

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
SCHEMBL31589682 0.85 BRD4 (0.70) BRD4CECR2BRD9
SCHEMBL31589718 0.84 CECR2 (0.57) BRD4CECR2BRD9TAF1
SCHEMBL31589663 0.80 CECR2 (0.60) BRD4CECR2BRD9TAF1
SCHEMBL22492908 0.76 BRD4 (1.00) BRD4CECR2
SCHEMBL31589737 0.74 BRD4 (0.64) BRD4CECR2BRD9TAF1
SCHEMBL31590222 0.72 GFER (0.44) BRD4BRD9
SCHEMBL19857631 0.72 BRD9 (0.56) BRD4CECR2BRD9TAF1
SCHEMBL17749810 0.71 CECR2 (0.71) BRD4CECR2BRD9TAF1
SCHEMBL30073236 0.71 CECR2 (0.71) BRD4CECR2BRD9TAF1
SCHEMBL17748956 0.71 CECR2 (1.00) BRD4CECR2BRD9TAF1

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-120040445-A Heterocyclopyridine-7-one compound and medical application thereof 浙江大学金华研究院 2025-05-27 — — CN disclosed
Send feedback