SCHEMBL31706109

SCHEMBL31706109

O=C(O)c1cncc(C2CCN(C(=O)C3COC3)CC2)c1

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ NAMPT P43490 7/20 0.40
▸ SCD5 Q86SK9 3/20 0.39
▸ SCD O00767 2/20 0.39
▸ CYP11B2 P19099 2/20 0.36
▸ LMNA P02545 2/20 0.36
▸ HTR2B P41595 1/20 0.36
▸ HCAR2 Q8TDS4 4/20 0.36
▸ TLR9 Q9NR96 1/20 0.36
▸ TLR8 Q9NR97 1/20 0.36
▸ TLR7 Q9NYK1 1/20 0.36
▸ POLB P06746 1/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ DDO Q99489 1/20 0.36

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
SCHEMBL31706383 0.89 HTR2B (0.44) SCD5SCDCYP11B2LMNAHTR2B
Lithium Ion SCHEMBL31706119 0.88 NAMPT (0.39) NAMPTSCD5SCDCYP11B2LMNA
Lithium Ion SCHEMBL31705497 0.88 NAMPT (0.39) NAMPTSCD5SCDCYP11B2LMNA
SCHEMBL31705199 0.87 NAMPT (0.41) NAMPTSCD5HTR2BTLR9TLR8
SCHEMBL31706230 0.85 ATM (0.42) NAMPTCYP11B2LMNAPOLBALDH1A1
SCHEMBL17067759 0.79 HCAR2 (0.50) CYP11B2LMNAHCAR2POLBKDM4E
SCHEMBL29810615 0.79 HCAR2 (0.50) CYP11B2LMNAHCAR2POLBKDM4E
SCHEMBL31705330 0.78 CYP11B2 (0.46) CYP11B2LMNAHCAR2POLBKDM4E
Lithium Ion SCHEMBL31705499 0.76 NAMPT (0.40) NAMPTHTR2BTLR9TLR8TLR7
Lithium Ion SCHEMBL31706665 0.76 HTR2B (0.40) NAMPTCYP11B2LMNAHTR2BTLR9

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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