SCHEMBL31532183

SCHEMBL31532183

FC(F)(F)c1ccc(-c2ccccc2Oc2ncc(Cl)cn2)nc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 1/20 0.49
▸ ALOX5AP P20292 5/20 0.44
▸ FEN1 P39748 5/20 0.44
▸ HPGD P15428 3/20 0.41
▸ POLB P06746 2/20 0.41
▸ NPSR1 Q6W5P4 2/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ L3MBTL1 Q9Y468 3/20 0.40
▸ CYP1A2 P05177 2/20 0.40
▸ CYP3A4 P08684 2/20 0.40
▸ CYP2C19 P33261 2/20 0.40
▸ TSHR P16473 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ CASP3 P42574 1/20 0.36
▸ CYP2D6 P10635 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ NTRK1 P04629 1/20 0.36
▸ KDM1A O60341 1/20 0.34

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
SCHEMBL16915372 1.00 KMT2A (0.49) KMT2AALOX5APFEN1HPGDPOLB
SCHEMBL11272729 0.86 KMT2A (0.51) KMT2AALOX5APFEN1HPGDPOLB
SCHEMBL31532200 0.84 CYP1A2 (0.41) KMT2AALOX5APFEN1POLBLMNA
SCHEMBL16915375 0.84 CYP1A2 (0.41) KMT2AALOX5APFEN1POLBLMNA
SCHEMBL16915408 0.84 KMT2A (0.52) KMT2AALOX5APFEN1HPGDPOLB
SCHEMBL31532176 0.84 KMT2A (0.52) KMT2AALOX5APFEN1HPGDPOLB
SCHEMBL16915396 0.82 ALOX5AP (0.42) KMT2AALOX5APFEN1HPGDPOLB
SCHEMBL16915377 0.78 ALOX5AP (0.45) KMT2AALOX5APFEN1HPGDPOLB
SCHEMBL31532178 0.78 ALOX5AP (0.45) KMT2AALOX5APFEN1HPGDPOLB
SCHEMBL16915394 0.76 CXCR1 (0.38) KMT2AALOX5APFEN1HPGDPOLB

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
CN-111574510-B Pyrimidine as herbicide Oxyphenyl derivatives FMC 公司 2025-03-07 — — CN disclosed
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