SCHEMBL31706056

SCHEMBL31706056

COc1cc(C(=O)O)nc(C2CCOCC2)n1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.51
▸ TDP1 Q9NUW8 1/20 0.51
▸ RBP4 P02753 1/20 0.38
▸ GPR35 Q9HC97 1/20 0.38
▸ ALOX15 P16050 1/20 0.38
▸ ALDH1A1 P00352 2/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ EHMT2 Q96KQ7 1/20 0.36
▸ EHMT1 Q9H9B1 1/20 0.36
▸ RORC P51449 1/20 0.35
▸ RAF1 P04049 1/20 0.35
▸ PIK3CA P42336 3/20 0.34
▸ HTR1A P08908 1/20 0.34
▸ DRD2 P14416 1/20 0.34
▸ DRD4 P21917 1/20 0.34
▸ MTOR P42345 1/20 0.34
▸ CFTR P13569 1/20 0.33
▸ TXNRD1 Q16881 1/20 0.33
▸ FPR2 P25090 1/20 0.33
▸ HPGDS O60760 1/20 0.33

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
SCHEMBL21200220 0.90 TDP1 (0.58) LMNATDP1RBP4GPR35ALOX15
SCHEMBL31706025 0.88 ALDH1A1 (0.43) LMNATDP1RBP4ALDH1A1KDM4E
SCHEMBL31705179 0.88 ALDH1A1 (0.43) LMNATDP1RBP4ALDH1A1KDM4E
SCHEMBL31704988 0.78 KMO (0.41) ALOX15ALDH1A1KDM4ERORCPIK3CA
SCHEMBL31705292 0.78 KMO (0.41) ALOX15ALDH1A1KDM4ERORCPIK3CA
SCHEMBL21200027 0.77 ALDH1A1 (0.49) LMNATDP1RBP4ALDH1A1KDM4E
SCHEMBL3113677 0.72 LMNA (0.51) LMNATDP1RBP4ALDH1A1KDM4E
SCHEMBL31706429 0.71 KDM4E (0.40) KDM4ERORCRAF1GRM5
SCHEMBL6341486 0.71 PDE10A (0.45) LMNAALDH1A1KDM4EHTR1ACYP1A2
SCHEMBL31704503 0.71 KDM4E (0.41) LMNATDP1RBP4ALOX15ALDH1A1

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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