SCHEMBL8934249

SCHEMBL8934249

CCCCCCCCCCC1CCC(c2ccc(-c3ccc(-c4ccc(OCCCCCCCCC)c(F)c4F)cc3)cc2F)CC1

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PTPN11 Q06124 5/20 0.35
PTPN1 P18031 1/20 0.34
PTPN6 P29350 1/20 0.34
OPRL1 P41146 6/20 0.33
FFAR4 Q5NUL3 2/20 0.33
S1PR1 P21453 2/20 0.33
FPR2 P25090 1/20 0.33
DGAT1 O75907 1/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
S1PR4 O95977 1/20 0.33
S1PR3 Q99500 1/20 0.33
S1PR5 Q9H228 1/20 0.33
SCN9A Q15858 1/20 0.32
RARA P10276 1/20 0.32
RARB P10826 1/20 0.32

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
SCHEMBL8934244 1.00 PTPN11 (0.35) PTPN11PTPN1PTPN6OPRL1FFAR4
SCHEMBL8934246 1.00 PTPN11 (0.35) PTPN11PTPN1PTPN6OPRL1FFAR4
SCHEMBL8934130 1.00 PTPN11 (0.35) PTPN11PTPN1PTPN6OPRL1FFAR4
SCHEMBL8934223 1.00 PTPN11 (0.35) PTPN11PTPN1PTPN6OPRL1FFAR4
SCHEMBL8934039 1.00 PTPN11 (0.35) PTPN11PTPN1PTPN6OPRL1FFAR4
SCHEMBL8934291 1.00 PTPN11 (0.35) PTPN11PTPN1PTPN6OPRL1FFAR4
SCHEMBL8934028 1.00 PTPN11 (0.35) PTPN11PTPN1PTPN6OPRL1FFAR4
SCHEMBL8934153 1.00 PTPN11 (0.35) PTPN11PTPN1PTPN6OPRL1FFAR4
SCHEMBL8934119 0.99 OPRL1 (0.34) PTPN11PTPN1PTPN6OPRL1FFAR4
SCHEMBL8934171 0.98 S1PR1 (0.35) PTPN11PTPN1PTPN6OPRL1FFAR4

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
EP-2206695-B1 TETRA- OR PENTA-CYCLIC LIQUID CRYSTALLINE COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY ELEMENT JNC CORP (JP) 2013-09-18 EP disclosed
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