SCHEMBL31733654

SCHEMBL31733654

O=C(CNC(=O)OCC1c2ccccc2-c2ccccc21)Oc1c(F)c(F)c(F)c(F)c1F

nearest known ligand 0.63

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.51
▸ EPHX2 P34913 1/20 0.46
▸ OPRD1 P41143 1/20 0.42
▸ CASP3 P42574 2/20 0.42
▸ FABP5 Q01469 2/20 0.40
▸ FABP7 O15540 1/20 0.40
▸ DPP8 Q6V1X1 1/20 0.39
▸ DPP9 Q86TI2 1/20 0.39

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
SCHEMBL29400520 1.00 KMT2A (0.51) KMT2AEPHX2OPRD1CASP3FABP5
SCHEMBL3060297 1.00 KMT2A (0.51) KMT2AEPHX2OPRD1CASP3FABP5
SCHEMBL29995975 0.95 KMT2A (0.48) KMT2AEPHX2OPRD1CASP3FABP5
SCHEMBL30895521 0.95 KMT2A (0.48) KMT2AEPHX2OPRD1CASP3FABP5
SCHEMBL3087950 0.88 KMT2A (0.58) KMT2AEPHX2CASP3FABP5FABP7
SCHEMBL29470973 0.84 KMT2A (0.57) KMT2AEPHX2OPRD1CASP3FABP5
SCHEMBL12391727 0.84 KMT2A (0.57) KMT2AEPHX2OPRD1CASP3FABP5
SCHEMBL7855942 0.84 KMT2A (0.69) KMT2AEPHX2CASP3
SCHEMBL17015150 0.84 KMT2A (0.57) KMT2AEPHX2OPRD1CASP3FABP5
SCHEMBL30174112 0.83 KMT2A (0.59) KMT2AEPHX2OPRD1CASP3FABP5

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-2025237891-A1 QUINOLINE-2-CARBOXAMIDE DERIVATIVES AS RAD51 INHIBITORS FOR THE TREATMENT OF CANCER NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2025-11-20 — — WO disclosed
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