SCHEMBL8944909

SCHEMBL8944909

CCCCCOc1ccc(-c2ccc(-c3ccc(C4CCC(CCC)OC4)c(F)c3)cc2)c(F)c1F

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 3/20 0.35
PTPN11 Q06124 3/20 0.31
RARA P10276 1/20 0.31
RARB P10826 1/20 0.31
PTPN1 P18031 1/20 0.30
PTPN6 P29350 1/20 0.30
S1PR1 P21453 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
SCHEMBL8945052 0.99 FPR2 (0.35) FPR2PTPN11RARARARBPTPN1
SCHEMBL8945037 0.99 FPR2 (0.35) FPR2PTPN11RARARARBPTPN1
SCHEMBL8945027 0.99 FPR2 (0.35) FPR2PTPN11RARARARBPTPN1
SCHEMBL8945183 0.99 FPR2 (0.35) FPR2PTPN11RARARARBPTPN1
SCHEMBL8945178 0.97 RARB (0.33) FPR2RARARARBS1PR1
SCHEMBL8945138 0.96 FPR2 (0.35) FPR2PTPN11RARARARBPTPN1
SCHEMBL18718393 0.96 FPR2 (0.34) FPR2PTPN11
SCHEMBL8945748 0.95 FPR2 (0.35) FPR2PTPN11RARARARBPTPN1
SCHEMBL8945439 0.95 FPR2 (0.35) FPR2PTPN11RARARARBPTPN1
SCHEMBL8945229 0.95 FPR2 (0.35) FPR2PTPN11RARARARBPTPN1

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