SCHEMBL30943197

SCHEMBL30943197

O=C(NCc1ccncc1)Nc1ccc2c(C(=O)N3CC4CCC(C3)O4)noc2c1

nearest known ligand 0.67

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ NAMPT P43490 17/20 0.67
▸ ALDH1A1 P00352 1/20 0.46
▸ RAB9A P51151 1/20 0.46
▸ CYP2C9 P11712 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
SCHEMBL24042552 1.00 NAMPT (0.67) NAMPTALDH1A1RAB9ACYP2C9
SCHEMBL20379364 0.81 NAMPT (1.00) NAMPTCYP2C9
SCHEMBL23320512 0.81 NAMPT (0.74) NAMPTALDH1A1RAB9A
SCHEMBL28620099 0.78 NAMPT (0.73) NAMPTALDH1A1RAB9A
SCHEMBL23320444 0.76 NAMPT (1.00) NAMPTALDH1A1RAB9A
SCHEMBL20379301 0.71 NAMPT (1.00) NAMPTCYP2C9
SCHEMBL23320477 0.71 NAMPT (0.60) NAMPTALDH1A1RAB9A
SCHEMBL30943224 0.71 NAMPT (0.84) NAMPT
SCHEMBL24042554 0.71 NAMPT (0.84) NAMPT
SCHEMBL23747750 0.67 NAMPT (0.73) NAMPTALDH1A1RAB9A

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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