SCHEMBL8950909

SCHEMBL8950909

C/C=C/C1COC(c2ccc(-c3ccc(-c4ccc(OCCCCCC)c(F)c4F)cc3)cc2F)OC1

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PTPN11 Q06124 5/20 0.33
FPR2 P25090 1/20 0.33
PTPN1 P18031 1/20 0.32
PTPN6 P29350 1/20 0.32
THRA P10827 1/20 0.31
THRB P10828 1/20 0.31

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
SCHEMBL8950875 1.00 PTPN11 (0.33) PTPN11FPR2PTPN1PTPN6THRA
SCHEMBL8950894 1.00 PTPN11 (0.33) PTPN11FPR2PTPN1PTPN6THRA
SCHEMBL8950900 1.00 PTPN11 (0.33) PTPN11FPR2PTPN1PTPN6THRA
SCHEMBL8950886 0.99 FPR2 (0.33) PTPN11FPR2PTPN1PTPN6
SCHEMBL8950874 0.96 S1PR1 (0.32) FPR2
SCHEMBL8950895 0.94 FPR2 (0.34) FPR2
SCHEMBL8952315 0.92 FPR2 (0.32) PTPN11FPR2THRATHRB
SCHEMBL8952400 0.92 FPR2 (0.32) PTPN11FPR2THRATHRB
SCHEMBL8952350 0.92 FPR2 (0.32) PTPN11FPR2THRATHRB
SCHEMBL8952407 0.92 FPR2 (0.32) PTPN11FPR2THRATHRB

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