SCHEMBL7902604

SCHEMBL7902604

CCc1ccc(-c2ccc(CCC3CCC(C4CCC(CCF)CC4)CC3)cc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 1/20 0.41
MAOB P27338 10/20 0.40
MAOA P21397 2/20 0.40
TAAR1 Q96RJ0 1/20 0.38
S1PR1 P21453 1/20 0.35
S1PR5 Q9H228 1/20 0.35
KCNH2 Q12809 2/20 0.34
HRH3 Q9Y5N1 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
SCHEMBL7902609 1.00 GPR84 (0.41) GPR84MAOBMAOATAAR1S1PR1
SCHEMBL7902599 1.00 GPR84 (0.41) GPR84MAOBMAOATAAR1S1PR1
SCHEMBL7902554 0.86 TAAR1 (0.39) GPR84MAOBMAOATAAR1KCNH2
SCHEMBL7902558 0.86 TAAR1 (0.39) GPR84MAOBMAOATAAR1KCNH2
SCHEMBL7902546 0.86 TAAR1 (0.39) GPR84MAOBMAOATAAR1KCNH2
SCHEMBL7902552 0.86 TAAR1 (0.39) GPR84MAOBMAOATAAR1KCNH2
SCHEMBL7902503 0.82 MAOB (0.38) GPR84MAOBMAOAKCNH2HRH3
SCHEMBL7902507 0.82 MAOB (0.38) GPR84MAOBMAOAKCNH2HRH3
SCHEMBL7902510 0.82 MAOB (0.38) GPR84MAOBMAOAKCNH2HRH3
SCHEMBL11061856 0.82 MAOB (0.44) GPR84MAOBMAOATAAR1S1PR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6174456-B1 STABILITY, LOW VISCOSITY AND HIGH TRANSITION TEMPERATURE OF THE ISOTROPIC PHASE CHISSO CORPORATION (JP) 2001-01-16 US disclosed
EP-0857708-A1 LIQUID CRYSTAL COMPOUNDS HAVING SUBSTITUTED ALKYL GROUPS, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY ELEMENT CHISSO CORPORATION (JP) 1998-08-12 EP disclosed