SCHEMBL8095853

SCHEMBL8095853

CCCCCCC(C)Cc1cccc(C(=O)Cl)c1

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 6/20 0.40
LTB4R Q15722 2/20 0.39
CSNK1E P49674 1/20 0.39
ACE2 Q9BYF1 1/20 0.39
CNR2 P34972 1/20 0.38
EPHX2 P34913 1/20 0.38
PLA2G4B P0C869 1/20 0.37
SPHK2 Q9NRA0 1/20 0.37
SPHK1 Q9NYA1 1/20 0.37
CYP4F2 P78329 1/20 0.37
CYP4A11 Q02928 1/20 0.37
PPARA Q07869 1/20 0.37

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
SCHEMBL8093908 0.99 FOLH1 (0.41) FOLH1LTB4RCNR2CYP4F2CYP4A11
SCHEMBL8094233 0.94 FOLH1 (0.40) FOLH1CNR2CYP4F2CYP4A11
SCHEMBL8087560 0.89 FOLH1 (0.40) FOLH1CYP4F2CYP4A11
SCHEMBL8093997 0.88 FOLH1 (0.41) FOLH1LTB4RCSNK1EACE2CNR2
SCHEMBL8096043 0.86 FOLH1 (0.42) FOLH1LTB4RCNR2CYP4F2CYP4A11
SCHEMBL8095515 0.83 SLC7A5 (0.41) FOLH1
SCHEMBL8085934 0.82 FOLH1 (0.41) FOLH1CNR2CYP4F2CYP4A11PPARA
SCHEMBL8102302 0.80 LPL (0.54) SPHK2SPHK1CYP4F2CYP4A11PPARA
SCHEMBL8087274 0.80 LPL (0.54) SPHK2SPHK1CYP4F2CYP4A11PPARA
SCHEMBL8094372 0.80 LPL (0.54) SPHK2SPHK1CYP4F2CYP4A11PPARA

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-0708077-B1 Diamino compounds and methods for preparing them CHISSO CORP (JP) 2000-12-27 EP disclosed
US-5663440-A Diamino compounds and methods for preparing them CHISSO CORPORATION (JP) 1997-09-02 US disclosed
EP-0708077-A1 Diamino compounds and methods for preparing them CHISSO CORPORATION (JP) 1996-04-24 EP disclosed