SCHEMBL5745847

SCHEMBL5745847

Cc1cc(Oc2cccc(C(F)(F)F)c2)nc(-c2ccc(Cl)nc2)n1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 1/20 0.48
L3MBTL1 Q9Y468 4/20 0.47
MAPT P10636 4/20 0.47
MAPK1 P28482 4/20 0.47
KMT2A Q03164 3/20 0.47
CYP1A2 P05177 2/20 0.47
CYP2C9 P11712 2/20 0.47
CYP2C19 P33261 2/20 0.47
MEN1 O00255 2/20 0.47
HPGD P15428 1/20 0.47
ATM Q13315 1/20 0.47
ALDH1A1 P00352 3/20 0.43
POLB P06746 1/20 0.43
KDM4E B2RXH2 1/20 0.43
RAB9A P51151 2/20 0.42
ABCG2 Q9UNQ0 1/20 0.42
SLC6A2 P23975 1/20 0.41
SLC6A4 P31645 1/20 0.41
SLC6A3 Q01959 1/20 0.41
NTRK1 P04629 1/20 0.41

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
SCHEMBL7006435 0.85 L3MBTL1 (0.58) FFAR4L3MBTL1MAPTMAPK1KMT2A
SCHEMBL7004883 0.83 L3MBTL1 (0.56) FFAR4L3MBTL1MAPTMAPK1KMT2A
SCHEMBL7006421 0.81 MAPT (0.53) FFAR4L3MBTL1MAPTMAPK1KMT2A
SCHEMBL17608849 0.79 ALDH1A1 (0.51) FFAR4L3MBTL1MAPTKMT2ACYP1A2
SCHEMBL7009823 0.76 S1PR1 (0.48) FFAR4L3MBTL1MAPTMAPK1KMT2A
SCHEMBL17623901 0.76 ALDH1A1 (0.53) FFAR4L3MBTL1MAPTMAPK1KMT2A
SCHEMBL7007084 0.76 FFAR4 (0.49) FFAR4L3MBTL1MAPTMAPK1KMT2A
SCHEMBL5750351 0.74 KMT2A (0.46) L3MBTL1MAPTMAPK1KMT2ACYP1A2
SCHEMBL30341595 0.74 CDK8 (0.50) L3MBTL1KMT2AALDH1A1POLBRAB9A
SCHEMBL16539369 0.74 CDK8 (0.50) L3MBTL1KMT2AALDH1A1POLBRAB9A

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0902026-B1 Herbicidal 2-azinyl-6-aryloxypyr(mi)dines BASF AG (DE) 2006-04-12 EP claimed
EP-0902026-A1 Herbicidal 2-azinyl-6-aryloxypyr (mi) dines American Cyanamid Company (US) 1999-03-17 EP claimed
EP-0902026-B1 Herbicidal 2-azinyl-6-aryloxypyr(mi)dines BASF AG (DE) 2006-04-12 EP disclosed
EP-0902026-A1 Herbicidal 2-azinyl-6-aryloxypyr (mi) dines American Cyanamid Company (US) 1999-03-17 EP disclosed