SCHEMBL9491128

SCHEMBL9491128

O=C(Cl)c1ccc(OC(F)=C(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)cc1

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.33
CA1 P00915 3/20 0.33
CA2 P00918 3/20 0.33
STS P08842 1/20 0.33
LMNA P02545 1/20 0.32
MAPT P10636 1/20 0.32
HTT P42858 1/20 0.32
ELANE P08246 5/20 0.31
HSD17B10 Q99714 1/20 0.30
CYP11B1 P15538 1/20 0.30
CYP11B2 P19099 1/20 0.30

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
SCHEMBL9615019 0.87 HSD17B10 (0.44) THRBCA1CA2STSELANE
SCHEMBL9469241 0.86 THRB (0.33) THRBCA1CA2
Hydrochloric Acid SCHEMBL10487854 0.86 HSD17B10 (0.43) THRBCA1CA2STSELANE
SCHEMBL10576681 0.85 HSD17B10 (0.45) THRBCA1CA2ELANEHSD17B10
SCHEMBL11093747 0.84 CA2 (0.41) THRBCA1CA2STS
Potassium Ion SCHEMBL11095737 0.84 CA1 (0.38) THRBCA1CA2STSLMNA
SCHEMBL10477026 0.80 ESR1 (0.33) THRBCA1CA2STSELANE
SCHEMBL10720930 0.80 LMNA (0.32) LMNAMAPTHTTELANEHSD17B10
SCHEMBL10720653 0.80 LMNA (0.32) LMNAMAPTHTTELANEHSD17B10
SCHEMBL10477041 0.79 LMNA (0.36) CA1CA2LMNAMAPTHTT

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
JP-59031725-A None JP disclosed
JP-1009958-A None JP disclosed
US-5187269-A Cellulose esters, water and moisture resistance DAIKIN INDUSTRIES LTD. (JP) 1993-02-16 US disclosed
JP-S649958-A FLUORINE-CONTAINING AROMATIC CARBOXYLIC ACID ESTER NEOS KK 1989-01-13 JP disclosed
JP-S5931725-A PREPARATION OF COMPOUND CONTAINING FLUORINE NEOS CO LTD 1984-02-20 JP disclosed
JP-S05931725-A 0001-01-01 JP disclosed