SCHEMBL8937847

SCHEMBL8937847

CCCCCCCC1CC=C(c2ccc(-c3ccc(-c4ccc(OCCC)c(F)c4F)cc3)cc2F)CC1

nearest known ligand 0.31

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PTPN11 Q06124 2/20 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
FFAR4 Q5NUL3 1/20 0.30
CCNT1 O60563 1/20 0.30
CDK9 P50750 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
SCHEMBL8937689 0.99 RARA (0.31) PTPN11RARARARBS1PR1FFAR4
SCHEMBL8937756 0.97 PTPN11 (0.34) PTPN11RARARARBPTPN1PTPN6
SCHEMBL8937928 0.97 PTPN11 (0.34) PTPN11RARARARBPTPN1PTPN6
SCHEMBL8937878 0.97 PTPN11 (0.34) PTPN11RARARARBPTPN1PTPN6
SCHEMBL8937752 0.97 PTPN11 (0.34) PTPN11RARARARBPTPN1PTPN6
SCHEMBL8937743 0.97 PTPN11 (0.34) PTPN11RARARARBPTPN1PTPN6
SCHEMBL8937749 0.97 PTPN11 (0.34) PTPN11RARARARBPTPN1PTPN6
SCHEMBL8937764 0.97 PTPN11 (0.34) PTPN11RARARARBPTPN1PTPN6
SCHEMBL8937967 0.97 PTPN11 (0.34) PTPN11RARARARBPTPN1PTPN6
SCHEMBL8937772 0.97 RARA (0.33) PTPN11RARARARBPTPN1PTPN6

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