SCHEMBL8635974

SCHEMBL8635974

Oc1ccc(Oc2ccc(C(F)(F)F)cc2)cc1C(F)(F)F

nearest known ligand 0.61

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ESRRA P11474 1/20 0.46
PDE4A P27815 1/20 0.46
PDE4B Q07343 1/20 0.46
PDE4C Q08493 1/20 0.46
PDE4D Q08499 1/20 0.46
THRB P10828 3/20 0.43
AR P10275 5/20 0.43
NQO2 P16083 1/20 0.42
KDM4E B2RXH2 1/20 0.41
LMNA P02545 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA9 Q16790 1/20 0.41
PTGS1 P23219 1/20 0.40
THRA P10827 1/20 0.39
LTA4H P09960 1/20 0.39
MAPK14 Q16539 1/20 0.38
KIF11 P52732 1/20 0.38

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
SCHEMBL16648399 0.91 ESRRA (0.49) ESRRATHRBARTHRA
SCHEMBL8633319 0.88 ESRRA (0.54) ESRRAAR
SCHEMBL8633068 0.86 AR (0.49) ESRRATHRBARTHRALTA4H
SCHEMBL8636487 0.85 THRA (0.46) THRBARKDM4ETHRALTA4H
SCHEMBL8636426 0.84 ESRRA (0.45) ESRRAAR
SCHEMBL8635438 0.84 LTA4H (0.50) ESRRAARNQO2LTA4H
SCHEMBL8637700 0.83 NPC1 (0.53) ESRRATHRBARLMNA
SCHEMBL8632090 0.83 AR (0.47) ESRRAARLTA4H
SCHEMBL8637194 0.82 SHBG (0.46) ESRRAPDE4AARPTGS1
SCHEMBL8633991 0.81 HSD17B1 (0.47) ESRRAARKDM4ELMNALTA4H

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0648729-B1 Dihalopropene compound, insecticide/acaricide containing said dihalopropene compound as active ingredient and intermediate compound for use in production of said dihalopropene compound SUMITOMO CHEMICAL CO (JP) 1998-07-15 EP disclosed
US-5698702-A INTERMEDIATES FOR INSECTICIDES, ACARICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1997-12-16 US disclosed
US-5530015-A Dihaloprene compound, insecticide/acaricide containing said dihalopropene compound as active ingredient, and intermediate compound for use in production of said dihalopropene compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1996-06-25 US disclosed
EP-0648729-A1 Dihalopropene compound, insecticide/acaricide containing said dihalopropene compound as active ingredient and intermediate compound for use in production of said dihalopropene compound SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1995-04-19 EP disclosed