SCHEMBL28663834

SCHEMBL28663834

COc1ccc(Cl)c2ccc(Nc3cc(C4CNCCO4)ccn3)nc12

nearest known ligand 0.52

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CCNT1 O60563 1/20 0.43
▸ CDK9 P50750 1/20 0.43

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
SCHEMBL28929166 0.87 — —
SCHEMBL28445773 0.74 — —
SCHEMBL28663832 0.74 INSR (0.46) —
SCHEMBL28672738 0.74 — —
SCHEMBL28660407 0.71 BRD4 (0.52) —
SCHEMBL25173561 0.68 DRD2 (0.50) —
SCHEMBL30160436 0.68 DRD2 (0.50) —
SCHEMBL12609710 0.68 — —
SCHEMBL12609712 0.68 — —
SCHEMBL25173543 0.68 SLC6A3 (0.60) —

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-113717158-A 2- (N- (pyridine-2-yl) amino) quinoline derivative and application thereof 河南省人民医院 2021-11-30 — — CN claimed
CN-113717158-A 2- (N- (pyridine-2-yl) amino) quinoline derivative and application thereof 河南省人民医院 2021-11-30 — — CN disclosed
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