SCHEMBL8409336

SCHEMBL8409336

ClC(Cl)=CCOc1cc(Cl)c(OCc2ccccc2Br)c(Cl)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP10 Q53GL7 1/20 0.39
ALDH1A1 P00352 2/20 0.37
FFAR4 Q5NUL3 2/20 0.37
FFAR1 O14842 1/20 0.37
IDO1 P14902 2/20 0.36
HTT P42858 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
MAPT P10636 1/20 0.36
THRA P10827 1/20 0.34
THRB P10828 1/20 0.34
CYP1A2 P05177 2/20 0.34
CYP3A4 P08684 2/20 0.34
CYP2D6 P10635 2/20 0.34
CYP2C19 P33261 2/20 0.34
MAOB P27338 1/20 0.34
CYP2C9 P11712 1/20 0.33
TSHR P16473 1/20 0.33
NR4A2 P43354 2/20 0.33

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
SCHEMBL8405491 0.88 NR4A2 (0.43) IDO1HTTSMN1; SMN2NPC1RAB9A
SCHEMBL8655964 0.85 RHEB (0.33) FFAR4FFAR1HTTNPC1RAB9A
SCHEMBL8408823 0.85 MAPT (0.44) PARP10ALDH1A1IDO1HTTSMN1; SMN2
SCHEMBL8407277 0.85 THRA (0.42) ALDH1A1HTTMAPTTHRATHRB
SCHEMBL8661891 0.82 FFAR4 (0.40) ALDH1A1FFAR4FFAR1THRATHRB
SCHEMBL8405667 0.82 NPC1 (0.44) PARP10FFAR1HTTSMN1; SMN2NPC1
SCHEMBL8408601 0.81 KDM4E (0.41) ALDH1A1SMN1; SMN2NPC1RAB9AMAPT
SCHEMBL8407693 0.79 MAOB (0.40) FFAR4FFAR1MAPTMAOB
SCHEMBL8407261 0.79 NR4A2 (0.42) IDO1HTTSMN1; SMN2NPC1RAB9A
SCHEMBL8408954 0.79 NR4A2 (0.46) ALDH1A1IDO1HTTSMN1; SMN2MAPT

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 2 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