SCHEMBL31705868

SCHEMBL31705868

O=C(O)c1csc(C2=CCN(C(=O)C3COC3)CC2)n1

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.38
▸ NAMPT P43490 8/20 0.37
▸ PLA2G10 O15496 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ HTR2C P28335 1/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ HPGDS O60760 1/20 0.35
▸ GAA P10253 1/20 0.35
▸ JAK2 O60674 1/20 0.35
▸ JAK1 P23458 1/20 0.35
▸ TYK2 P29597 1/20 0.35

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
Lithium Ion SCHEMBL31705930 0.89 NAMPT (0.36) ALDH1A1NAMPTSMN1; SMN2HTR2CKDM4E
SCHEMBL31704939 0.87 MAOA (0.38) NAMPTJAK2JAK1TYK2
SCHEMBL31705462 0.87 MAOA (0.38) NAMPTJAK2JAK1TYK2
SCHEMBL31705626 0.79 NAMPT (0.41) ALDH1A1NAMPTSMN1; SMN2KDM4EGAA
SCHEMBL31706435 0.77 ALDH1A1 (0.48) ALDH1A1NAMPTSMN1; SMN2KDM4EGAA
SCHEMBL31706346 0.76 NAMPT (0.42) ALDH1A1NAMPTSMN1; SMN2KDM4EGAA
Lithium Ion SCHEMBL31705934 0.73 NAMPT (0.39) ALDH1A1NAMPTHTR2CKDM4EGAA
Lithium Ion SCHEMBL31704541 0.73 NAMPT (0.39) ALDH1A1NAMPTHTR2CKDM4EGAA
Lithium Ion SCHEMBL31705492 0.73 NAMPT (0.40) ALDH1A1NAMPTSMN1; SMN2HTR2CKDM4E
Lithium Ion SCHEMBL31706711 0.73 NAMPT (0.40) ALDH1A1NAMPTSMN1; SMN2HTR2CKDM4E

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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