SCHEMBL8635830

SCHEMBL8635830

CC(C)Oc1ccc(Cc2ccc(OCC=C(Cl)Cl)c(Br)c2)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.36
CYP1A2 P05177 1/20 0.36
GAA P10253 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C19 P33261 1/20 0.36
PLAU P00749 1/20 0.36
PTGES O14684 1/20 0.35
HTT P42858 2/20 0.34
MAPT P10636 2/20 0.34
KDM4A O75164 1/20 0.34
KDM4C Q9H3R0 1/20 0.34
MAPK1 P28482 1/20 0.34
SMN1; SMN2 Q16637 3/20 0.34
KDM4E B2RXH2 2/20 0.34
ALDH1A3 P47895 1/20 0.33
NPC1 O15118 1/20 0.33
LMNA P02545 1/20 0.33
HPGD P15428 1/20 0.33
RAB9A P51151 1/20 0.33
PPARD Q03181 1/20 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
SCHEMBL8634718 0.89 POLB (0.37) POLBCYP1A2GAACYP2D6CYP2C19
SCHEMBL8636720 0.85 ACACB (0.37) POLBCYP1A2GAACYP2D6CYP2C19
SCHEMBL8632153 0.82 PLAU (0.35) POLBCYP1A2GAACYP2D6CYP2C19
SCHEMBL8632744 0.78 PLAU (0.35) POLBPLAUHTTMAPTSMN1; SMN2
SCHEMBL8636445 0.74 ACACB (0.38) POLBCYP1A2GAACYP2D6CYP2C19
SCHEMBL8635590 0.74 POLB (0.45) POLBCYP1A2GAACYP2D6CYP2C19
SCHEMBL8635966 0.73 THRB (0.39) POLBCYP1A2GAACYP2D6CYP2C19
SCHEMBL8634698 0.73 HTT (0.37) CYP1A2GAACYP2D6CYP2C19HTT
SCHEMBL8634567 0.72 ADRA2A (0.37) POLBCYP1A2GAACYP2D6CYP2C19
SCHEMBL8636137 0.72 ACACB (0.36) POLBCYP2D6HTTMAPTSMN1; SMN2

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
EP-0648729-B1 Dihalopropene compound, insecticide/acaricide containing said dihalopropene compound as active ingredient and intermediate compound for use in production of said dihalopropene compound SUMITOMO CHEMICAL CO (JP) 1998-07-15 EP disclosed
US-5698702-A INTERMEDIATES FOR INSECTICIDES, ACARICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1997-12-16 US disclosed
US-5530015-A Dihaloprene compound, insecticide/acaricide containing said dihalopropene compound as active ingredient, and intermediate compound for use in production of said dihalopropene compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1996-06-25 US disclosed
EP-0648729-A1 Dihalopropene compound, insecticide/acaricide containing said dihalopropene compound as active ingredient and intermediate compound for use in production of said dihalopropene compound SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1995-04-19 EP disclosed