SCHEMBL8939747

SCHEMBL8939747

CCCCCCOc1ccc(-c2ccc(-c3ccc(C4CCC(CCCCC)CO4)cc3F)cc2)c(F)c1F

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
RARB P10826 1/20 0.33
KDM1A O60341 2/20 0.32
FPR2 P25090 3/20 0.32
PPARD Q03181 1/20 0.31
PTPN11 Q06124 1/20 0.31
FASN P49327 1/20 0.30

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
SCHEMBL8939917 1.00 RARB (0.33) RARBKDM1AFPR2PPARDPTPN11
SCHEMBL8939771 1.00 RARB (0.33) RARBKDM1AFPR2PPARDPTPN11
SCHEMBL8939763 1.00 RARB (0.33) RARBKDM1AFPR2PPARDPTPN11
SCHEMBL8939930 1.00 RARB (0.33) RARBKDM1AFPR2PPARDPTPN11
SCHEMBL8939904 1.00 RARB (0.33) RARBKDM1AFPR2PPARDPTPN11
SCHEMBL8939749 1.00 RARB (0.33) RARBKDM1AFPR2PPARDPTPN11
SCHEMBL8939911 1.00 RARB (0.33) RARBKDM1AFPR2PPARDPTPN11
SCHEMBL8939913 1.00 RARB (0.33) RARBKDM1AFPR2PPARDPTPN11
SCHEMBL8939732 0.99 KDM1A (0.32) RARBKDM1AFPR2PPARDFASN
SCHEMBL8939887 0.98 KDM1A (0.32) RARBKDM1AFPR2PPARDFASN

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8187494-B2 Four- or five-ring liquid crystal compound having lateral fluorine, liquid crystal composition, and liquid crystal display device JNC CORPORATION (JP) 2012-05-29 US disclosed