SCHEMBL31704658

SCHEMBL31704658

COC(=O)c1cncc(C2=CCN(C(=O)C3COC3)CC2)c1

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ NAMPT P43490 13/20 0.42
▸ ATM Q13315 1/20 0.41
▸ CYP11B2 P19099 3/20 0.41
▸ MTOR P42345 1/20 0.40
▸ CYP2A6 P11509 1/20 0.39
▸ CYP11B1 P15538 2/20 0.38
▸ CCNT1 O60563 1/20 0.38
▸ CDK9 P50750 1/20 0.38

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
SCHEMBL31704700 0.90 NAMPT (0.48) NAMPTATMCYP11B2CYP2A6CYP11B1
SCHEMBL31706700 0.87 NAMPT (0.43) NAMPTCYP11B2
Lithium Ion SCHEMBL31704850 0.85 NAMPT (0.42) NAMPT
Lithium Ion SCHEMBL31705374 0.85 NAMPT (0.42) NAMPT
SCHEMBL31704818 0.84 QDPR (0.51) NAMPTATMCYP11B2CYP2A6CYP11B1
SCHEMBL31705649 0.82 NAMPT (0.42) NAMPTCCNT1CDK9
SCHEMBL31704732 0.80 CCNT1 (0.44) NAMPTCCNT1CDK9
SCHEMBL31705879 0.80 CYP11B2 (0.56) NAMPTATMCYP11B2
SCHEMBL31705195 0.79 NAMPT (0.41) NAMPTCCNT1CDK9
SCHEMBL31705209 0.79 NAMPT (0.41) NAMPTCCNT1CDK9

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
WO-2025215110-A1 NEW AMIDE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND THEIR USES AS SOS1 INHIBITORS LES LABORATOIRES SERVIER (FR) 2025-10-16 — — WO disclosed
Send feedback