SCHEMBL8428182

SCHEMBL8428182

FCCCC1CCC(C2CCC(CCc3ccc(C(F)(F)F)cc3)CC2)CC1

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAOB P27338 4/20 0.50
TAAR1 Q96RJ0 1/20 0.46
TEAD1 P28347 2/20 0.39
MIF P14174 1/20 0.36
HDAC1 Q13547 1/20 0.36
HDAC8 Q9BY41 1/20 0.36
DAO P14920 1/20 0.35
GAA P10253 1/20 0.35

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
SCHEMBL8431479 0.87 MAOB (0.49) MAOBTAAR1TEAD1HDAC1HDAC8
SCHEMBL4800385 0.85 MAOB (0.48) MAOBTAAR1TEAD1
SCHEMBL4800377 0.85 MAOB (0.48) MAOBTAAR1TEAD1
SCHEMBL21581466 0.84 MAOB (0.48) MAOBTAAR1
SCHEMBL7902546 0.83 TAAR1 (0.39) MAOBTAAR1
SCHEMBL7902558 0.83 TAAR1 (0.39) MAOBTAAR1
SCHEMBL4795942 0.83 MAOB (0.51) MAOBTAAR1TEAD1MIFHDAC1
SCHEMBL7902554 0.83 TAAR1 (0.39) MAOBTAAR1
SCHEMBL4795951 0.83 MAOB (0.51) MAOBTAAR1TEAD1MIFHDAC1
SCHEMBL7902552 0.83 TAAR1 (0.39) MAOBTAAR1

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-0718264-B1 A liquid crystalline compound containing fluorine atom substituted alkyl group(s) and a liquid crystal composition CHISSO CORP (JP) 1999-11-17 EP disclosed
US-5702641-A ELECTRICAL AND CHEMICAL STABILITY CHISSO CORPORATION (JP) 1997-12-30 US disclosed
CN-1130670-A Liquid crystalline compound containing fluorine atom substituted alkyl group(s) and a liquid crystal composition CHISSO CORP (JP) 1996-09-11 CN disclosed
EP-0718264-A1 A liquid crystalline compound containing fluorine atom substituted alkyl group(s) and a liquid crystal composition Chisso Corporation (JP) 1996-06-26 EP disclosed