SCHEMBL31705334

SCHEMBL31705334

COC(=O)c1cc(OC)nc(N2CCOCC2)n1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 6/20 0.49
▸ TSHR P16473 3/20 0.47
▸ NPSR1 Q6W5P4 1/20 0.47
▸ PIK3CA P42336 1/20 0.47
▸ MTOR P42345 1/20 0.47
▸ PIK3CG P48736 1/20 0.47
▸ KCNQ3 O43525 2/20 0.47
▸ KCNQ2 O43526 2/20 0.47
▸ SMN1; SMN2 Q16637 3/20 0.46
▸ CYP1A2 P05177 1/20 0.45
▸ PKM P14618 1/20 0.45
▸ CYP2C19 P33261 1/20 0.45
▸ KMT2A Q03164 3/20 0.44
▸ GLA P06280 1/20 0.44
▸ HSD17B10 Q99714 2/20 0.44
▸ HPGD P15428 1/20 0.44
▸ MAPK1 P28482 2/20 0.44
▸ MEN1 O00255 2/20 0.43
▸ KDM4E B2RXH2 2/20 0.43
▸ LMNA P02545 1/20 0.43

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
SCHEMBL3113677 0.88 LMNA (0.51) ALDH1A1PIK3CAKCNQ3KCNQ2SMN1; SMN2
SCHEMBL18002721 0.87 ALDH1A1 (0.49) ALDH1A1TSHRNPSR1KCNQ3KCNQ2
SCHEMBL3997688 0.86 ALDH1A1 (0.51) ALDH1A1TSHRNPSR1PIK3CAMTOR
SCHEMBL13494000 0.85 RBP4 (0.58) ALDH1A1TSHRNPSR1PIK3CAMTOR
SCHEMBL11926409 0.84 ALDH1A1 (0.49) ALDH1A1TSHRNPSR1PIK3CAMTOR
SCHEMBL3117274 0.83 SMN1; SMN2 (0.46) ALDH1A1TSHRNPSR1PIK3CAMTOR
SCHEMBL5528861 0.82 ALDH1A1 (0.47) ALDH1A1TSHRNPSR1PIK3CAMTOR
SCHEMBL5557945 0.82 ALDH1A1 (0.47) ALDH1A1TSHRNPSR1PIK3CAMTOR
SCHEMBL3991404 0.79 MAPT (0.51) ALDH1A1NPSR1PIK3CAMTORSMN1; SMN2
SCHEMBL7016486 0.79 MEN1 (0.51) ALDH1A1TSHRNPSR1PIK3CAMTOR

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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