SCHEMBL7859008

SCHEMBL7859008

CCCCCc1ccc(C#Cc2ccc(C#Cc3ccc(CCCC)cc3)c(F)c2)cc1F

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 12/20 0.41
FFAR4 Q5NUL3 10/20 0.41
HSD17B10 Q99714 2/20 0.40
TSHR P16473 1/20 0.40
HTR2A P28223 1/20 0.39
PTPN11 Q06124 1/20 0.38
PTPRO Q16827 1/20 0.38
RARB P10826 2/20 0.37
RARA P10276 1/20 0.37
RARG P13631 1/20 0.37
TSPO P30536 1/20 0.37
DRD3 P35462 1/20 0.37
ACACB O00763 1/20 0.36
S1PR1 P21453 1/20 0.36
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
ESR1 P03372 1/20 0.36
SHBG P04278 1/20 0.36
TP53 P04637 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
SCHEMBL7861622 1.00 FFAR1 (0.41) FFAR1FFAR4HSD17B10TSHRHTR2A
SCHEMBL7858582 1.00 FFAR1 (0.41) FFAR1FFAR4HSD17B10TSHRHTR2A
SCHEMBL7861628 1.00 FFAR1 (0.41) FFAR1FFAR4HSD17B10TSHRHTR2A
SCHEMBL7861649 0.99 HSD17B10 (0.42) FFAR1FFAR4HSD17B10TSHRHTR2A
SCHEMBL7851475 0.99 HSD17B10 (0.42) FFAR1FFAR4HSD17B10TSHRHTR2A
SCHEMBL7858539 0.99 HSD17B10 (0.42) FFAR1FFAR4HSD17B10TSHRHTR2A
SCHEMBL7857807 0.99 HSD17B10 (0.42) FFAR1FFAR4HSD17B10TSHRHTR2A
SCHEMBL7859972 0.99 HSD17B10 (0.42) FFAR1FFAR4HSD17B10TSHRHTR2A
SCHEMBL7859950 0.99 HSD17B10 (0.42) FFAR1FFAR4HSD17B10TSHRHTR2A
SCHEMBL8014883 0.99 HSD17B10 (0.42) FFAR1FFAR4HSD17B10TSHRHTR2A

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