SCHEMBL31706293

SCHEMBL31706293

CCOC(=O)c1nnc(C2CCN(C(C)=O)CC2)s1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.47
GAA P10253 3/20 0.47
TSHR P16473 2/20 0.47
HSD17B10 Q99714 2/20 0.47
HTT P42858 1/20 0.47
REV1 Q9UBZ9 3/20 0.42
HPGD P15428 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
BAZ2A Q9UIF9 1/20 0.36
OGA O60502 1/20 0.36
MAPT P10636 2/20 0.36
FDFT1 P37268 1/20 0.36
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
POLB P06746 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 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
SCHEMBL31704827 0.88 ALDH1A1 (0.46) ALDH1A1GAATSHRHSD17B10HTT
SCHEMBL20305362 0.86 ALDH1A1 (0.49) ALDH1A1GAATSHRHSD17B10HTT
SCHEMBL31704512 0.84 ALDH1A1 (0.48) ALDH1A1GAATSHRHSD17B10HTT
SCHEMBL31705064 0.81 QDPR (0.42) ALDH1A1HSD17B10L3MBTL1POLBQDPR
SCHEMBL31706753 0.80 ALDH1A1 (0.44) ALDH1A1GAATSHRHSD17B10HTT
SCHEMBL31705910 0.78 HCRTR2 (0.48) ALDH1A1GAATSHRHSD17B10HTT
SCHEMBL19734504 0.77 ALDH1A1 (0.40) ALDH1A1GAATSHRHSD17B10HTT
SCHEMBL17374333 0.75 ALDH1A1 (0.39) ALDH1A1GAATSHRHSD17B10HTT
SCHEMBL975828 0.72 ALDH1A1 (0.56) ALDH1A1GAATSHRHSD17B10HTT
SCHEMBL21452278 0.70 BAZ2A (0.38) ALDH1A1GAATSHRHSD17B10HTT

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