SCHEMBL8662200

SCHEMBL8662200

CC(C)Oc1cccc(OCCCOc2c(Cl)cc(OCC=C(Cl)Cl)cc2Cl)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLAU P00749 2/20 0.46
KDM4E B2RXH2 2/20 0.46
ALDH1A1 P00352 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
NSD2 O96028 1/20 0.46
L3MBTL1 Q9Y468 4/20 0.40
NPSR1 Q6W5P4 1/20 0.38
PPARD Q03181 5/20 0.36
PPARA Q07869 2/20 0.36
HTT P42858 1/20 0.36
PPARG P37231 3/20 0.35
MEN1 O00255 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
RECQL P46063 1/20 0.34
KMT2A Q03164 1/20 0.34
GRK2 P25098 1/20 0.34
FFAR1 O14842 2/20 0.34

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
SCHEMBL8659993 0.98 PLAU (0.46) PLAUKDM4EALDH1A1SMN1; SMN2NSD2
SCHEMBL8406348 0.90 HTT (0.40) PLAUKDM4EALDH1A1SMN1; SMN2NSD2
SCHEMBL8661626 0.89 THRA (0.37) PLAUKDM4EALDH1A1SMN1; SMN2NSD2
SCHEMBL8407599 0.87 HTT (0.40) PLAUKDM4EALDH1A1SMN1; SMN2NSD2
SCHEMBL8661858 0.87 MAPK1 (0.47) KDM4EALDH1A1L3MBTL1MEN1CYP1A2
SCHEMBL8659537 0.87 MAPK1 (0.41) KDM4EALDH1A1SMN1; SMN2L3MBTL1NPSR1
SCHEMBL8658470 0.86 THRA (0.37) PLAUKDM4EALDH1A1SMN1; SMN2NSD2
SCHEMBL8658605 0.84 PPARG (0.44) KDM4ESMN1; SMN2PPARDHTTPPARG
SCHEMBL6547645 0.83 MAOB (0.46) ALDH1A1SMN1; SMN2HTTMEN1KMT2A
SCHEMBL8657380 0.83 HTT (0.38) PLAUKDM4EALDH1A1SMN1; SMN2L3MBTL1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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