SCHEMBL8093858

SCHEMBL8093858

CCCCCc1cccc(Cc2cccc(C)c2)c1

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.52
LPL P06858 3/20 0.51
LIPG Q9Y5X9 3/20 0.51
CNR1 P21554 2/20 0.51
CNR2 P34972 2/20 0.51
HRH3 Q9Y5N1 1/20 0.44
PPARG P37231 1/20 0.43
PPARA Q07869 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43

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
SCHEMBL8086306 0.98 LPL (0.53) TAAR1LPLLIPGCNR1CNR2
SCHEMBL8095815 0.98 LPL (0.53) TAAR1LPLLIPGCNR1CNR2
SCHEMBL8098390 0.98 LPL (0.53) TAAR1LPLLIPGCNR1CNR2
SCHEMBL8096717 0.95 TAAR1 (0.53) TAAR1LPLLIPGCNR1CNR2
SCHEMBL598872 0.93 TAAR1 (0.59) TAAR1LPLLIPGCNR1CNR2
SCHEMBL8780379 0.91 LPL (0.59) TAAR1LPLLIPGCNR1CNR2
SCHEMBL9485795 0.91 LPL (0.59) TAAR1LPLLIPGCNR1CNR2
SCHEMBL105418 0.91 LPL (0.59) TAAR1LPLLIPGCNR1CNR2
SCHEMBL28041371 0.91 LPL (0.59) TAAR1LPLLIPGCNR1CNR2
SCHEMBL11073651 0.91 LPL (0.59) TAAR1LPLLIPGCNR1CNR2

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