SCHEMBL8408972

SCHEMBL8408972

Oc1cc(Cl)c(OCCCc2ccc(OC(F)(F)F)cc2)c(Cl)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 1/20 0.48
TRPV1 Q8NER1 1/20 0.42
FFAR4 Q5NUL3 5/20 0.41
SCN5A Q14524 2/20 0.41
SCN8A Q9UQD0 1/20 0.41
CYP3A4 P08684 1/20 0.41
KCNH2 Q12809 1/20 0.41
CACNA1C Q13936 1/20 0.41
FFAR1 O14842 2/20 0.39
CYP2C9 P11712 1/20 0.39
PPARD Q03181 1/20 0.39
PPARA Q07869 1/20 0.39
DAO P14920 1/20 0.39
NLRP3 Q96P20 1/20 0.38
MRGPRX4 Q96LA9 2/20 0.38
GRIN2B Q13224 1/20 0.38
AKR1C2 P52895 1/20 0.38
AKR1C1 Q04828 1/20 0.38
RHEB Q15382 1/20 0.38
SLC6A5 Q9Y345 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
SCHEMBL8409439 0.96 GPR84 (0.47) GPR84TRPV1FFAR4SCN5ASCN8A
SCHEMBL8408796 0.93 GPR84 (0.49) GPR84TRPV1FFAR4SCN5ASCN8A
SCHEMBL8405415 0.87 FFAR4 (0.47) GPR84FFAR4SCN5ACYP3A4KCNH2
SCHEMBL8405614 0.87 FFAR4 (0.47) GPR84FFAR4SCN5ACYP3A4KCNH2
SCHEMBL8405824 0.86 GPR84 (0.46) GPR84TRPV1NLRP3MRGPRX4GRIN2B
SCHEMBL8407327 0.86 CNR1 (0.45) TRPV1FFAR4SCN5ACYP3A4KCNH2
SCHEMBL8407708 0.84 FFAR4 (0.50) FFAR4SCN5ACYP3A4KCNH2CACNA1C
SCHEMBL8409230 0.83 MAOB (0.40) SCN8AFFAR1PPARDMRGPRX4
SCHEMBL8408446 0.82 CNR1 (0.44) TRPV1FFAR4SCN5ACYP3A4KCNH2
SCHEMBL8657400 0.82 FFAR4 (0.39) GPR84TRPV1FFAR4SCN5ASCN8A

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