SCHEMBL8970346

SCHEMBL8970346

CCCCCCCCOc1ccc(-c2ccc(-c3ccc(C#CC4COC(CCCCC)OC4)c(F)c3)cc2)c(F)c1F

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PTPN11 Q06124 2/20 0.32
PTPN1 P18031 1/20 0.31
PTPN6 P29350 1/20 0.31
ALDH1A1 P00352 1/20 0.31
HPGD P15428 1/20 0.31
FPR2 P25090 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
SCHEMBL8970345 0.93 ALDH1A1 (0.31) PTPN11ALDH1A1HPGD
SCHEMBL8970216 0.87 RARB (0.32) FPR2
SCHEMBL8970465 0.85 FPR2 (0.31) PTPN11FPR2
SCHEMBL8970206 0.84 NAAA (0.31)
SCHEMBL8955113 0.83 FPR2 (0.36) PTPN11PTPN1PTPN6FPR2
SCHEMBL8955134 0.83 FPR2 (0.36) PTPN11PTPN1PTPN6FPR2
SCHEMBL8954956 0.83 FPR2 (0.36) PTPN11PTPN1PTPN6FPR2
SCHEMBL8954921 0.83 FPR2 (0.36) PTPN11PTPN1PTPN6FPR2
SCHEMBL8955053 0.83 FPR2 (0.36) PTPN11PTPN1PTPN6FPR2
SCHEMBL8954957 0.83 FPR2 (0.36) PTPN11PTPN1PTPN6FPR2

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