SCHEMBL8950464

SCHEMBL8950464

CCCCCCCC1COC(c2ccc(-c3ccc(-c4ccc(OCCCCCC)c(F)c4F)cc3)cc2F)OC1

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PTPN11 Q06124 5/20 0.34
FPR2 P25090 3/20 0.34
PTPN1 P18031 1/20 0.33
PTPN6 P29350 1/20 0.33
S1PR1 P21453 2/20 0.31
THRA P10827 1/20 0.31
THRB P10828 1/20 0.31
S1PR4 O95977 1/20 0.30
S1PR3 Q99500 1/20 0.30
S1PR5 Q9H228 1/20 0.30
RARB P10826 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
SCHEMBL8950395 1.00 PTPN11 (0.34) PTPN11FPR2PTPN1PTPN6S1PR1
SCHEMBL8950526 1.00 PTPN11 (0.34) PTPN11FPR2PTPN1PTPN6S1PR1
SCHEMBL8950404 1.00 PTPN11 (0.34) PTPN11FPR2PTPN1PTPN6S1PR1
SCHEMBL8950470 1.00 PTPN11 (0.34) PTPN11FPR2PTPN1PTPN6S1PR1
SCHEMBL8950459 1.00 PTPN11 (0.34) PTPN11FPR2PTPN1PTPN6S1PR1
SCHEMBL8950448 1.00 PTPN11 (0.34) PTPN11FPR2PTPN1PTPN6S1PR1
SCHEMBL8950136 1.00 PTPN11 (0.34) PTPN11FPR2PTPN1PTPN6S1PR1
SCHEMBL8950409 1.00 PTPN11 (0.34) PTPN11FPR2PTPN1PTPN6S1PR1
SCHEMBL8950130 0.99 FPR2 (0.35) PTPN11FPR2PTPN1PTPN6S1PR1
SCHEMBL8950377 0.98 FPR2 (0.33) PTPN11FPR2PTPN1PTPN6S1PR1

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