SCHEMBL8320103

SCHEMBL8320103

CNC(=O)Nc1cc(Oc2ccc(C(F)(F)F)cc2Cl)ccc1Cl

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 3/20 0.51
MAPT P10636 4/20 0.50
MEN1 O00255 3/20 0.50
KMT2A Q03164 3/20 0.50
TTR P02766 1/20 0.50
PPOX P50336 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
HTR2A P28223 3/20 0.49
SLC6A4 P31645 3/20 0.49
KCNH2 Q12809 3/20 0.49
CHRNA7 P36544 1/20 0.48
CYP1A2 P05177 3/20 0.47
CYP3A4 P08684 3/20 0.47
CYP2C19 P33261 3/20 0.47
CYP2D6 P10635 2/20 0.47
CYP2C9 P11712 1/20 0.47
BRAF P15056 1/20 0.47
KDR P35968 1/20 0.47
KDM4E B2RXH2 2/20 0.46
TP53 P04637 1/20 0.46

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
SCHEMBL9054295 0.91 CYP1A2 (0.47) FFAR1MAPTMEN1KMT2ATTR
SCHEMBL8320988 0.86 TDP1 (0.65) FFAR1MAPTMEN1KMT2ATTR
SCHEMBL13451876 0.84 CHRNA7 (0.64) MAPTMEN1KMT2AKCNH2CHRNA7
SCHEMBL11099693 0.83 STK39 (0.54) MEN1KMT2ACYP1A2CYP3A4CYP2C19
SCHEMBL8319542 0.82 MAPT (0.48) FFAR1MAPTBRAFKDRALDH1A1
SCHEMBL11303832 0.80 FFAR1 (0.55) FFAR1MAPTMEN1KMT2ATTR
SCHEMBL4362329 0.79 TRPV1 (0.57) FFAR1MAPTMEN1KMT2ATTR
SCHEMBL11584206 0.78 STK39 (0.65) BRAFKDR
SCHEMBL29448825 0.77 TDP1 (0.58) FFAR1MAPTMEN1KMT2ATTR
SCHEMBL11854430 0.77 TDP1 (0.58) FFAR1MAPTMEN1KMT2ATTR

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
US-5883282-A UREA CHEMICAL INTERMEDIATES; RICE AMERICAN CYANAMID COMPANY (US) 1999-03-16 US disclosed
US-5763605-A 3-(3-aryloxyphenyl)-1-(substituted methyl)-S-triazine-2,4,6-oxo or thiotrione herbicidal agents AMERICAN CYANAMID COMPANY (US) 1998-06-09 US disclosed
US-5670641-A 3-(3-aryloxyphenyl)-1-(substituted methyl)-S-triazine-2,4,6-oxo or thiotrione herbicidal agents AMERICAN CYANAMID COMPANY (US) 1997-09-23 US disclosed
US-5654256-A PREEMERGENCE, POSTEMERGENCE HERBICIDES AMERICAN CYANAMID COMPANY (US) 1997-08-05 US disclosed
US-5604180-A RICE CROPS AMERICAN CYANAMID COMPANY 1997-02-18 US disclosed
US-5519133-A CYCLIZATION, ALKYLATION AMERICAN CYANAMID CO. (US) 1996-05-21 US disclosed