SCHEMBL7858593

SCHEMBL7858593

CCCCc1ccc(C#Cc2ccc(C#Cc3ccc(CCC)c(F)c3)c(F)c2)cc1

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 18/20 0.42
FFAR4 Q5NUL3 16/20 0.42
TSPO P30536 1/20 0.37
DRD3 P35462 1/20 0.37
ACACB O00763 1/20 0.37
PTPN11 Q06124 1/20 0.36
PTPRO Q16827 1/20 0.36

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
SCHEMBL7857762 1.00 FFAR1 (0.42) FFAR1FFAR4TSPODRD3ACACB
SCHEMBL7851568 0.96 FFAR1 (0.45) FFAR1FFAR4TSPODRD3ACACB
SCHEMBL7851694 0.96 FFAR1 (0.41) FFAR1FFAR4TSPODRD3ACACB
SCHEMBL7858774 0.96 FFAR1 (0.41) FFAR1FFAR4TSPODRD3ACACB
SCHEMBL7857633 0.96 FFAR1 (0.43) FFAR1FFAR4TSPODRD3ACACB
SCHEMBL7851714 0.96 FFAR1 (0.43) FFAR1FFAR4TSPODRD3ACACB
SCHEMBL7858544 0.95 HSD17B10 (0.42) FFAR1FFAR4TSPODRD3PTPN11
SCHEMBL7858546 0.95 HSD17B10 (0.42) FFAR1FFAR4TSPODRD3PTPN11
SCHEMBL7857683 0.95 HSD17B10 (0.42) FFAR1FFAR4TSPODRD3PTPN11
SCHEMBL7851493 0.95 HSD17B10 (0.42) FFAR1FFAR4TSPODRD3PTPN11

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