SCHEMBL8635966

SCHEMBL8635966

CC(C)Oc1ccc(Oc2ccc(OCC=C(Cl)Cl)c(C(C)C)c2)cc1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
THRB P10828 3/20 0.39
RORC P51449 3/20 0.39
ACACB O00763 4/20 0.37
ACACA Q13085 4/20 0.37
HTT P42858 1/20 0.36
P2RX3 P56373 1/20 0.32
P2RX2 Q9UBL9 1/20 0.32
CYP1A2 P05177 1/20 0.32
GAA P10253 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C19 P33261 1/20 0.32
POLB P06746 1/20 0.32
ALDH1A3 P47895 1/20 0.32
PTGDR Q13258 1/20 0.32
FFAR4 Q5NUL3 2/20 0.31
GCK P35557 1/20 0.31

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
SCHEMBL8635790 0.93 PTGDR (0.37) THRBRORCACACBACACAHTT
SCHEMBL8635792 0.91 THRB (0.35) THRBRORCACACBACACAHTT
SCHEMBL8635806 0.90 ACACB (0.36) THRBRORCACACBACACAHTT
SCHEMBL8634858 0.90 HTT (0.39) THRBRORCACACBACACAHTT
SCHEMBL8638478 0.89 ACACB (0.35) THRBRORCACACBACACAHTT
SCHEMBL8632642 0.89 LTA4H (0.42) THRBRORCACACBACACAHTT
SCHEMBL8635018 0.89 THRB (0.40) THRBRORCHTTCYP1A2CYP2C19
SCHEMBL8632604 0.88 ACACB (0.37) THRBRORCACACBACACAP2RX3
SCHEMBL8636137 0.86 ACACB (0.36) ACACBACACAHTTCYP2D6POLB
SCHEMBL8636720 0.85 ACACB (0.37) THRBRORCACACBACACAHTT

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