SCHEMBL8339152

SCHEMBL8339152

Cc1cc(OC/C=C(/F)Br)cc(Cl)c1O

nearest known ligand 0.33

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.33
POLB P06746 1/20 0.33
CYP2D6 P10635 1/20 0.33
TSHR P16473 1/20 0.33
CYP2C19 P33261 1/20 0.33
MCL1 Q07820 2/20 0.32
PTGS1 P23219 1/20 0.31
PTGS2 P35354 1/20 0.31
OGG1 O15527 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
SIRT1 Q96EB6 1/20 0.30
HPGD P15428 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
SCHEMBL8339154 1.00 CYP1A2 (0.33) CYP1A2POLBCYP2D6TSHRCYP2C19
SCHEMBL8341173 0.89 HSD17B10 (0.34) CYP1A2TSHRCYP2C19
SCHEMBL8341181 0.89 HSD17B10 (0.34) CYP1A2TSHRCYP2C19
SCHEMBL7981782 0.88 MCL1 (0.33) CYP1A2POLBCYP2D6TSHRCYP2C19
SCHEMBL8341190 0.87 MCL1 (0.33) CYP1A2POLBCYP2D6TSHRCYP2C19
SCHEMBL8341187 0.87 MCL1 (0.33) CYP1A2POLBCYP2D6TSHRCYP2C19
SCHEMBL7075218 0.83 HTT (0.40) CYP1A2POLBCYP2D6TSHRCYP2C19
SCHEMBL8341507 0.81 KDM4E (0.32) CYP1A2PTGS1PTGS2HPGD
SCHEMBL8341510 0.81 KDM4E (0.32) CYP1A2PTGS1PTGS2HPGD
SCHEMBL7977624 0.76 HSD17B10 (0.37) CYP1A2POLBTSHRCYP2C19MCL1

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
EP-0787710-B1 Fluoropropene compound, an insecticide containing the same and an intermediate for production thereof SUMITOMO CHEMICAL CO (JP) 1999-07-28 EP disclosed
US-5869506-A APPLYING TO ACARIDS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-02-09 US disclosed
EP-0787710-A1 Fluoropropene compound, an insecticide containing the same and an intermediate for production thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1997-08-06 EP disclosed