SCHEMBL8408641

SCHEMBL8408641

Oc1cc(Cl)c(OCc2cc(Oc3ccccc3)ccc2Br)c(Cl)c1

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.40
NR1H2 P55055 1/20 0.40
BAX Q07812 1/20 0.40
THRA P10827 5/20 0.39
THRB P10828 5/20 0.39
HSP90AA1 P07900 1/20 0.38
NR4A2 P43354 2/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
MAOB P27338 1/20 0.36
STK39 Q9UEW8 1/20 0.36
NAAA Q02083 1/20 0.36
CAMK2A Q9UQM7 1/20 0.35
RHEB Q15382 2/20 0.35
FFAR1 O14842 1/20 0.35
FFAR4 Q5NUL3 1/20 0.35
GPR84 Q9NQS5 1/20 0.35
PARP10 Q53GL7 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
SCHEMBL8655964 0.84 RHEB (0.33) LTA4HNR1H2BAXTHRATHRB
SCHEMBL8405445 0.80 FFAR1 (0.49) LTA4HNR1H2BAXTHRATHRB
SCHEMBL8407311 0.80 IDO1 (0.46) THRATHRBNPC1RAB9AMAOB
SCHEMBL2290427 0.78 THRA (0.41) LTA4HTHRATHRBMAOBNAAA
SCHEMBL8405485 0.78 FFAR1 (0.51) FFAR1FFAR4
SCHEMBL8405740 0.75 CACNA1C (0.39) THRATHRBHSP90AA1NPC1RAB9A
SCHEMBL8405539 0.74 PPARG (0.47) LTA4HNR1H2BAXTHRATHRB
SCHEMBL11312730 0.74 LTA4H (0.43) LTA4HNR1H2BAXMAOBNAAA
SCHEMBL5784934 0.74 LTA4H (0.53) LTA4HNR1H2BAXMAOBNAAA
SCHEMBL8405973 0.73 PPARG (0.47) NR4A2MAOBFFAR1FFAR4

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