SCHEMBL7850776

SCHEMBL7850776

CCCc1ccc(C#Cc2ccc(C#Cc3ccc(CCC)c(F)c3)c(F)c2)cc1F

nearest known ligand 0.49

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 19/20 0.49
FFAR4 Q5NUL3 16/20 0.49
TSPO P30536 1/20 0.43
DRD3 P35462 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
SCHEMBL7858562 0.93 FFAR1 (0.45) FFAR1FFAR4TSPODRD3
SCHEMBL7859951 0.93 FFAR1 (0.47) FFAR1FFAR4TSPODRD3
SCHEMBL7858743 0.93 FFAR1 (0.45) FFAR1FFAR4TSPODRD3
SCHEMBL7858765 0.91 FFAR1 (0.44) FFAR1FFAR4TSPODRD3
SCHEMBL7858535 0.91 FFAR1 (0.48) FFAR1FFAR4TSPODRD3
SCHEMBL7858739 0.91 FFAR1 (0.48) FFAR1FFAR4TSPODRD3
SCHEMBL7861610 0.91 FFAR1 (0.44) FFAR1FFAR4TSPODRD3
SCHEMBL7858696 0.90 FFAR1 (0.44) FFAR1FFAR4TSPODRD3
SCHEMBL7859840 0.90 FFAR1 (0.55) FFAR1FFAR4TSPODRD3
SCHEMBL7857762 0.89 FFAR1 (0.42) FFAR1FFAR4TSPODRD3

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-6168728-B1 OPTICS WITH HIGH ANISOTROPIC VALUE CHISSO CORPORATION (JP) 2001-01-02 US disclosed
EP-0968988-A1 ACETYLENE DERIVATIVES, AND LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE EACH COMPRISING THE SAME CHISSO CORPORATION (JP) 2000-01-05 EP disclosed