SCHEMBL7635349

SCHEMBL7635349

CCCCOC(COCCCCCOc1c(C)cc(O)cc1CC)OCCCC

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
THRA P10827 1/20 0.37
THRB P10828 1/20 0.37
CNR2 P34972 5/20 0.37
LPAR1 Q92633 2/20 0.35
LPAR3 Q9UBY5 2/20 0.35
GPR84 Q9NQS5 2/20 0.35
PLA2G4B P0C869 1/20 0.35
CNR1 P21554 4/20 0.35
PLA2G2A P14555 3/20 0.35
PLA2G10 O15496 1/20 0.35
PLA2G1B P04054 1/20 0.35
PLA2G5 P39877 1/20 0.35
NR5A1 Q13285 1/20 0.35
TP53 P04637 1/20 0.35
TSHR P16473 1/20 0.35

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
SCHEMBL7635648 0.99 THRA (0.35) THRATHRBCNR2LPAR1LPAR3
SCHEMBL7631089 0.94 THRA (0.35) THRATHRBCNR2LPAR1LPAR3
SCHEMBL7631817 0.93 THRA (0.33) THRATHRBGPR84
SCHEMBL7627671 0.93 CNR2 (0.39) CNR2LPAR1LPAR3GPR84PLA2G4B
SCHEMBL7637630 0.91 CNR2 (0.38) CNR2LPAR1LPAR3GPR84CNR1
SCHEMBL7636825 0.90 THRA (0.33) THRATHRBCNR2GPR84CNR1
SCHEMBL7629897 0.89 CYP3A4 (0.32) THRATHRB
SCHEMBL7629203 0.86 THRA (0.34) THRATHRBLPAR1LPAR3GPR84
SCHEMBL7635710 0.86 GPR84 (0.36) THRATHRBCNR2LPAR1LPAR3
SCHEMBL7631624 0.85 THRA (0.31) THRATHRB

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-0888270-B1 DIHALOPROPENE COMPOUNDS, THEIR USE AS INSECTICIDES/ACARICIDES AND INTERMEDIATES FOR THEIR PRODUCTION SUMITOMO CHEMICAL CO (JP) 2002-04-17 EP disclosed
US-6140274-A Dihalopropene compounds, their use as insecticides/acaricides and intermediates for their production SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-10-31 US disclosed
EP-0888270-A1 DIHALOPROPENE COMPOUNDS, THEIR USE AS INSECTICIDES/ACARICIDES AND INTERMEDIATES FOR THEIR PRODUCTION SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1999-01-07 EP disclosed
WO-1997028112-A1 DIHALOPROPENE COMPOUNDS, THEIR USE AS INSECTICIDES/ACARICIDES AND INTERMEDIATES FOR THEIR PRODUCTION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1997-08-07 WO disclosed