SCHEMBL30943200

SCHEMBL30943200

COCCOc1ccccc1-n1cc2ccc(NC(=O)NCc3ccncc3)cc2n1

nearest known ligand 0.67

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ NAMPT P43490 17/20 0.67
▸ IMPDH2 P12268 1/20 0.45
▸ HTT P42858 1/20 0.44

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
SCHEMBL24042559 1.00 NAMPT (0.67) NAMPTIMPDH2HTT
SCHEMBL23320389 0.80 NAMPT (1.00) NAMPTIMPDH2HTT
SCHEMBL24042588 0.79 NAMPT (0.77) NAMPTHTT
SCHEMBL23320396 0.76 NAMPT (0.36) NAMPT
SCHEMBL23320566 0.75 NAMPT (0.35) NAMPT
SCHEMBL30943213 0.74 NAMPT (0.75) NAMPT
SCHEMBL23320417 0.74 NAMPT (0.75) NAMPT
SCHEMBL23320533 0.74 NAMPT (0.75) NAMPTIMPDH2
SCHEMBL30943229 0.74 NAMPT (0.75) NAMPTIMPDH2
SCHEMBL23320407 0.72 FBP1 (0.38) HTT

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-112654608-B Fused ring compound having urea structure 桑福德伯纳姆普利斯医学发现研究所 2024-05-07 — — CN disclosed
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