SCHEMBL8635872

SCHEMBL8635872

CCOc1ccc(Oc2ccc(OCC=C(Br)Br)c(C(C)C)c2)c(Cl)c1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
THRB P10828 5/20 0.41
RORC P51449 4/20 0.41
ACACB O00763 6/20 0.41
HTR2A P28223 3/20 0.36
SLC6A4 P31645 3/20 0.36
MAPT P10636 1/20 0.36
KCNH2 Q12809 2/20 0.34
FFAR1 O14842 1/20 0.34
MEN1 O00255 1/20 0.34
TSHR P16473 1/20 0.34
KMT2A Q03164 1/20 0.34
ERN1 O75460 1/20 0.34
THRA P10827 2/20 0.33

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
SCHEMBL8634914 0.90 THRB (0.42) THRBRORCACACBHTR2ASLC6A4
SCHEMBL8634769 0.87 LTA4H (0.42) THRBRORCACACBSLC6A4MAPT
SCHEMBL8632756 0.84 MAPT (0.39) THRBRORCACACBSLC6A4MAPT
SCHEMBL8636796 0.82 AR (0.42) ACACBHTR2ASLC6A4MAPTKCNH2
SCHEMBL8637643 0.82 THRB (0.40) THRBRORCACACBMAPTFFAR1
SCHEMBL8634095 0.81 THRB (0.40) THRBRORCHTR2ASLC6A4KCNH2
SCHEMBL8634701 0.80 THRB (0.35) THRBRORCHTR2ASLC6A4KCNH2
SCHEMBL8635020 0.80 LTA4H (0.40) THRBRORCMEN1KMT2A
SCHEMBL8631679 0.79 THRB (0.51) THRBRORCMEN1TSHRKMT2A
SCHEMBL8632604 0.79 ACACB (0.37) THRBRORCACACBKMT2ATHRA

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