SCHEMBL31704700

SCHEMBL31704700

COC(=O)c1cncc(C2=CCN(C(=O)C3CC3)CC2)c1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ NAMPT P43490 9/20 0.48
▸ JAK1 P23458 3/20 0.45
▸ ATM Q13315 1/20 0.44
▸ CYP11B2 P19099 3/20 0.43
▸ CYP2A6 P11509 1/20 0.41
▸ CYP11B1 P15538 2/20 0.41
▸ JAK2 O60674 1/20 0.41
▸ TYK2 P29597 1/20 0.41
▸ KIT P10721 1/20 0.41
▸ KDM4E B2RXH2 1/20 0.40
▸ USP2 O75604 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ GAA P10253 1/20 0.40
▸ ALOX15 P16050 1/20 0.40
▸ TSHR P16473 1/20 0.40

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
SCHEMBL31704658 0.90 NAMPT (0.42) NAMPTATMCYP11B2CYP2A6CYP11B1
SCHEMBL31704818 0.87 QDPR (0.51) NAMPTATMCYP11B2CYP2A6CYP11B1
SCHEMBL31705506 0.86 JAK1 (0.45) NAMPTJAK1JAK2TYK2KDM4E
SCHEMBL31706191 0.84 NAMPT (0.47) NAMPTJAK1JAK2TYK2KDM4E
SCHEMBL31704895 0.84 NAMPT (0.47) NAMPTJAK1JAK2TYK2KDM4E
Lithium Ion SCHEMBL31704634 0.84 JAK1 (0.44) NAMPTJAK1JAK2TYK2KIT
Lithium Ion SCHEMBL31705494 0.84 JAK1 (0.44) NAMPTJAK1JAK2TYK2KIT
SCHEMBL31705879 0.82 CYP11B2 (0.56) NAMPTJAK1ATMCYP11B2
SCHEMBL31704866 0.79 NAMPT (0.49) NAMPTJAK1JAK2TYK2KIT
SCHEMBL31706700 0.76 NAMPT (0.43) NAMPTJAK1CYP11B2KDM4EUSP2

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
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