SCHEMBL8120652

SCHEMBL8120652

Cc1cc(Oc2cccc(C(F)(F)F)c2)nc(Oc2csc(C(F)(F)F)c2)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.46
LRRK2 Q5S007 1/20 0.42
ALDH1A1 P00352 3/20 0.42
L3MBTL1 Q9Y468 3/20 0.42
POLB P06746 2/20 0.42
KDM4E B2RXH2 4/20 0.41
RAB9A P51151 1/20 0.41
NPSR1 Q6W5P4 4/20 0.41
CYP1A2 P05177 2/20 0.41
CYP2C9 P11712 2/20 0.41
CYP2C19 P33261 2/20 0.41
ABCG2 Q9UNQ0 1/20 0.40
LMNA P02545 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
MCOLN3 Q8TDD5 1/20 0.40
MAPK1 P28482 2/20 0.40
ADORA2A P29274 1/20 0.40
F10 P00742 1/20 0.39
GAA P10253 2/20 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
SCHEMBL8121468 0.90 MAPT (0.52) MAPTLRRK2ALDH1A1L3MBTL1POLB
SCHEMBL8120425 0.89 MAPT (0.47) MAPTLRRK2ALDH1A1L3MBTL1POLB
SCHEMBL8507324 0.87 MAPT (0.56) MAPTLRRK2ALDH1A1L3MBTL1POLB
SCHEMBL8121568 0.87 LMNA (0.34) MAPTL3MBTL1POLBKDM4ECYP1A2
SCHEMBL8118203 0.81 HAO1 (0.37) POLBKDM4ECYP1A2CYP2C9CYP2C19
SCHEMBL8653740 0.80 MAPT (0.45) MAPTLRRK2ALDH1A1L3MBTL1POLB
SCHEMBL8127225 0.79 NUDT1 (0.38) MAPTALDH1A1L3MBTL1KDM4ECYP1A2
SCHEMBL8125826 0.79 SOS1 (0.34) L3MBTL1POLBKDM4ECYP1A2CYP2C9
SCHEMBL8031385 0.78
SCHEMBL7108274 0.77 MAPT (0.61) MAPTLRRK2ALDH1A1L3MBTL1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1028959-A1 HERBICIDAL FURANYL- AND THIENYLOXYAZINES AMERICAN CYANAMID COMPANY (US) 2000-08-23 EP claimed
WO-1999024427-A1 HERBICIDAL FURANYL- AND THIENYLOXYAZINES AMERICAN CYANAMID COMPANY (US) 1999-05-20 WO claimed
US-5851952-A Herbicidal thienyloxyazines AMERICAN CYANAMID COMPANY (US) 1998-12-22 US claimed
EP-1028959-A1 HERBICIDAL FURANYL- AND THIENYLOXYAZINES AMERICAN CYANAMID COMPANY (US) 2000-08-23 EP disclosed
WO-1999024427-A1 HERBICIDAL FURANYL- AND THIENYLOXYAZINES AMERICAN CYANAMID COMPANY (US) 1999-05-20 WO disclosed
US-5851952-A Herbicidal thienyloxyazines AMERICAN CYANAMID COMPANY (US) 1998-12-22 US disclosed