SCHEMBL8773219

SCHEMBL8773219

Cc1cc(Oc2cccc(C(F)(F)F)c2)nc(Oc2cccc(C(F)(F)F)c2)c1S

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.55
KDM4E B2RXH2 3/20 0.55
NPSR1 Q6W5P4 3/20 0.50
MAPT P10636 3/20 0.50
KMT2A Q03164 2/20 0.50
LMNA P02545 1/20 0.50
MEN1 O00255 1/20 0.50
MCOLN3 Q8TDD5 1/20 0.50
F10 P00742 1/20 0.46
CYP1A2 P05177 2/20 0.46
CYP2C9 P11712 2/20 0.46
CYP2C19 P33261 2/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
ABCG2 Q9UNQ0 1/20 0.45
RECQL P46063 1/20 0.45
ADORA2A P29274 1/20 0.44
POLB P06746 2/20 0.44
PPP1CA P62136 1/20 0.42
LRRK2 Q5S007 1/20 0.42
TEAD1 P28347 2/20 0.42

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
SCHEMBL7055147 0.86 MAPT (0.47) ALDH1A1KDM4ENPSR1MAPTKMT2A
SCHEMBL7110925 0.82 MAPT (0.52) ALDH1A1KDM4ENPSR1MAPTLMNA
SCHEMBL8550502 0.81 ALDH1A1 (0.43) ALDH1A1KDM4ENPSR1MAPTKMT2A
SCHEMBL8072821 0.79 MAPT (0.52) ALDH1A1KDM4ENPSR1MAPTF10
SCHEMBL8507324 0.79 MAPT (0.56) ALDH1A1KDM4ENPSR1MAPTKMT2A
SCHEMBL17623901 0.75 ALDH1A1 (0.53) ALDH1A1KDM4ENPSR1MAPTKMT2A
SCHEMBL29607042 0.75 MAPT (0.65) ALDH1A1KDM4ENPSR1MAPTLMNA
SCHEMBL8773158 0.75 MAPT (0.65) ALDH1A1KDM4ENPSR1MAPTLMNA
SCHEMBL17772777 0.75 MAPT (0.61) ALDH1A1KDM4ENPSR1MAPTKMT2A
SCHEMBL8773209 0.75 MAPT (0.58) ALDH1A1KDM4ENPSR1MAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5691277-A REACTING A 2,6-DIHALOGENOPYRIDINE WITH A META SUBSTITUTED PHENOL KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1997-11-25 US disclosed
EP-0692474-B1 2- (unsubstituted or substituted) (benzyloxy or phenoxy)-4-substituted-6-(meta-substituted phenoxy) pyridine, process for producing the same, and herbicidal composition KUREHA CHEMICAL IND CO LTD (JP) 1997-10-29 EP disclosed
EP-0692474-A1 2- (unsubstituted or substituted) (benzyloxy or phenoxy)-4-substituted-6-(meta-substituted phenoxy) pyridine, process for producing the same, and herbicidal composition KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1996-01-17 EP disclosed