SCHEMBL31705446

SCHEMBL31705446

Cc1cc(C(=O)O)cc(C2=CCCN(C(=O)C3COC3)C2)c1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ MYC P01106 2/20 0.40
▸ TPMT P51580 1/20 0.36
▸ ALDH1A1 P00352 2/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ HCAR1 Q9BXC0 1/20 0.33
▸ GRM5 P41594 1/20 0.32
▸ RXRA P19793 1/20 0.31
▸ RXRB P28702 1/20 0.31
▸ CNR2 P34972 1/20 0.31
▸ MEN1 O00255 1/20 0.30
▸ KMT2A Q03164 1/20 0.30

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 SCHEMBL31706036 0.89 MYC (0.33) MYCALDH1A1NPSR1HPGDGRM5
SCHEMBL31705400 0.88 CNR2 (0.36) MYCALDH1A1NPSR1HPGDGRM5
SCHEMBL31705394 0.75 CHRM4 (0.34) ALDH1A1NPSR1HPGD
Lithium Ion SCHEMBL31705507 0.74 NAMPT (0.30) —
SCHEMBL31704822 0.69 NAMPT (0.42) ALDH1A1
SCHEMBL31706700 0.67 NAMPT (0.43) ALDH1A1
SCHEMBL31704801 0.65 NR1H2 (0.43) CNR2MEN1KMT2A
SCHEMBL17231196 0.64 TPMT (0.76) TPMTALDH1A1HPGDHCAR1RXRA
SCHEMBL31705199 0.64 NAMPT (0.41) ALDH1A1HPGDMEN1KMT2A
SCHEMBL31706346 0.62 NAMPT (0.42) ALDH1A1

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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