SCHEMBL8405447

SCHEMBL8405447

COc1cccc(COc2c(Cl)cc(O)cc2Cl)c1

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAOB P27338 8/20 0.54
IDO1 P14902 2/20 0.53
AGXT P21549 2/20 0.53
MRGPRX4 Q96LA9 2/20 0.49
ABCB1 P08183 1/20 0.49
HTR1A P08908 1/20 0.49
DRD2 P14416 1/20 0.49
GABRA1 P14867 1/20 0.48
GABRG2 P18507 1/20 0.48
GABRB3 P28472 1/20 0.48
GABRA3 P34903 1/20 0.48
GABRA2 P47869 1/20 0.48
GABRB2 P47870 1/20 0.48
ALDH1A1 P00352 1/20 0.47
HTT P42858 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47

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
SCHEMBL8408376 0.85 CYP4F2 (0.56) MAOBMRGPRX4ALDH1A1
SCHEMBL8405485 0.84 FFAR1 (0.51) MRGPRX4
SCHEMBL8409305 0.83 CALM1 (0.50) MAOBIDO1AGXTSMN1; SMN2
SCHEMBL4896413 0.83 MRGPRX4 (0.57) MAOBMRGPRX4ALDH1A1HTTSMN1; SMN2
SCHEMBL8408975 0.82 FFAR1 (0.55) MAOBMRGPRX4
SCHEMBL8408385 0.82 MAOB (0.45) MAOBIDO1AGXTMRGPRX4ABCB1
SCHEMBL8408484 0.81 THRA (0.52) MAOBIDO1MRGPRX4HTR1A
SCHEMBL8408318 0.81 MRGPRX4 (0.47) MAOBMRGPRX4
SCHEMBL8405973 0.81 PPARG (0.47) MAOBMRGPRX4ALDH1A1
SCHEMBL8409016 0.81 MRGPRX4 (0.47) MAOBMRGPRX4

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
US-5872137-A AROMATIC OXY DIHALOPRENE COMPOUNDS INSECTICIDAL/ACARICIDAL AGENTS CONTAINING SAME, AND INTERMEDIATES FOR THEIR PRODUCTION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-02-16 US disclosed
EP-0722430-B1 DIHALOPROPENE COMPOUNDS, INSECTICIDAL/ACARICIDAL AGENTS CONTAINING SAME, AND INTERMEDIATES FOR THEIR PRODUCTION SUMITOMO CHEMICAL CO (JP) 1998-10-21 EP disclosed
EP-0722430-A1 DIHALOPROPENE COMPOUNDS, INSECTICIDAL/ACARICIDAL AGENTS CONTAINING SAME, AND INTERMEDIATES FOR THEIR PRODUCTION SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1996-07-24 EP disclosed
WO-1996004228-A1 DIHALOPROPENE COMPOUNDS, INSECTICIDAL/ACARICIDAL AGENTS CONTAINING SAME, AND INTERMEDIATES FOR THEIR PRODUCTION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1996-02-15 WO disclosed