SCHEMBL8320672

SCHEMBL8320672

O=C(Cl)c1cc(Oc2c(F)cc(C(F)(F)F)cc2Cl)ccc1Br

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.39
TTR P02766 1/20 0.39
PPOX P50336 1/20 0.39
KMT2A Q03164 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
TLR8 Q9NR97 9/20 0.38
TLR7 Q9NYK1 5/20 0.38
THRB P10828 5/20 0.38
THRA P10827 3/20 0.36
FFAR1 O14842 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
SCHEMBL8321859 0.91 MEN1 (0.46) MEN1TTRPPOXKMT2ATDP1
SCHEMBL8325245 0.89 HDAC3 (0.39) MEN1TTRPPOXKMT2ATDP1
SCHEMBL9751312 0.89 MEN1 (0.41) MEN1TTRPPOXKMT2ATDP1
SCHEMBL11865317 0.83 MEN1 (0.49) MEN1TTRPPOXKMT2ATDP1
SCHEMBL9751497 0.82 TDP1 (0.58) MEN1TTRPPOXKMT2ATDP1
SCHEMBL9751346 0.81 MEN1 (0.48) MEN1TTRPPOXKMT2ATDP1
SCHEMBL9796491 0.81 MEN1 (0.58) MEN1TTRPPOXKMT2ATDP1
SCHEMBL10482278 0.80 TLR8 (0.36) TLR8TLR7THRBTHRA
SCHEMBL11856491 0.80 NOTUM (0.43) MEN1TTRPPOXKMT2ATDP1
SCHEMBL10803315 0.78 TLR7 (0.42) TLR8TLR7THRBTHRA

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 7 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
EP-0745595-A1 3-(3-Aryloxyphenyl)-1-(substituted methyl)-s-triazine-2,4,6-oxo or thiotrione herbicidal agents American Cyanamid Company (US) 1996-12-04 EP disclosed
US-5519133-A CYCLIZATION, ALKYLATION AMERICAN CYANAMID CO. (US) 1996-05-21 US disclosed