SCHEMBL8456549

SCHEMBL8456549

FCCC=C[C@H]1CC[C@H](CCc2ccc(-c3ccc(F)cc3)cc2)CC1

nearest known ligand 0.41

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MAOB P27338 3/20 0.41
KCNH2 Q12809 2/20 0.35
GPR84 Q9NQS5 1/20 0.34
TAAR1 Q96RJ0 1/20 0.33
TRPA1 O75762 1/20 0.31

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
SCHEMBL8456543 1.00 MAOB (0.41) MAOBKCNH2GPR84TAAR1TRPA1
SCHEMBL8456541 1.00 MAOB (0.41) MAOBKCNH2GPR84TAAR1TRPA1
SCHEMBL8456548 1.00 MAOB (0.41) MAOBKCNH2GPR84TAAR1TRPA1
SCHEMBL8453516 0.92 MAOB (0.41) MAOBKCNH2TAAR1TRPA1
SCHEMBL8453520 0.92 MAOB (0.41) MAOBKCNH2TAAR1TRPA1
SCHEMBL8453512 0.92 MAOB (0.41) MAOBKCNH2TAAR1TRPA1
SCHEMBL8453651 0.88 GPR84 (0.34) MAOBKCNH2GPR84TAAR1
SCHEMBL8449329 0.88 MAOB (0.40) MAOBKCNH2GPR84
SCHEMBL8453302 0.88 MAOB (0.40) MAOBKCNH2GPR84TAAR1
SCHEMBL8453290 0.88 MAOB (0.40) MAOBKCNH2GPR84TAAR1

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-0679707-B1 Liquid crystalline compound, liquid crystal composition and liquid crystal display element CHISSO CORP (JP) 1999-06-16 EP disclosed
US-5720899-A Liquid crystalline compound, liquid crystal composition and liquid crystal display element CHISSO CORPORATION (JP) 1998-02-24 US disclosed
US-5653911-A Liquid crystalline compound liquid crystal composition and liquid crystal display element CHISSO CORPORATION (JP) 1997-08-05 US disclosed
EP-0679707-A1 Liquid crystalline compound, liquid crystal composition and liquid crystal display element Chisso Corporation (JP) 1995-11-02 EP disclosed