SCHEMBL8098362

SCHEMBL8098362

CCCCCc1cccc(Cc2cccc(CCCCC)c2)c1

nearest known ligand 0.63

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LPL P06858 3/20 0.59
LIPG Q9Y5X9 3/20 0.59
TDP1 Q9NUW8 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
PPARG P37231 2/20 0.49
PPARA Q07869 2/20 0.49
CYP3A4 P08684 1/20 0.47
PTGS2 P35354 1/20 0.47
KCNH2 Q12809 1/20 0.46
SPHK2 Q9NRA0 2/20 0.46
SPHK1 Q9NYA1 2/20 0.46

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
SCHEMBL8099381 0.98 LPL (0.61) LPLLIPGTDP1L3MBTL1PPARG
SCHEMBL8086818 0.98 LPL (0.61) LPLLIPGTDP1L3MBTL1PPARG
SCHEMBL8102161 0.98 LPL (0.61) LPLLIPGTDP1L3MBTL1PPARG
SCHEMBL8095304 0.96 LPL (0.56) LPLLIPGTDP1L3MBTL1PPARG
SCHEMBL10106221 0.94 LPL (0.54) LPLLIPGTDP1L3MBTL1PPARG
SCHEMBL8085699 0.94 LPL (0.57) LPLLIPGPPARGPPARACYP3A4
SCHEMBL8095321 0.94 LPL (0.57) LPLLIPGPPARGPPARACYP3A4
SCHEMBL8094550 0.94 LPL (0.57) LPLLIPGPPARGPPARACYP3A4
SCHEMBL5433566 0.93 LPL (0.52) LPLLIPGTDP1L3MBTL1PPARG
SCHEMBL8518305 0.93 LPL (0.66) LPLLIPGTDP1L3MBTL1PPARG

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