SCHEMBL6666043

SCHEMBL6666043

CCCc1ccc(COC(F)(F)Cc2cc(F)c(C#N)c(F)c2)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPV4 Q9HBA0 1/20 0.36
ALDH1A1 P00352 4/20 0.35
MEN1 O00255 1/20 0.35
MAPT P10636 1/20 0.35
KMT2A Q03164 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
HPGD P15428 3/20 0.33
KDM4E B2RXH2 2/20 0.33
GAA P10253 2/20 0.33
GLA P06280 1/20 0.33
BCAT2 O15382 3/20 0.32
CTSS P25774 1/20 0.32
CTSK P43235 1/20 0.32
ALPL P05186 1/20 0.31
ALPI P09923 1/20 0.31
GPR84 Q9NQS5 1/20 0.31
SENP8 Q96LD8 1/20 0.31
SENP7 Q9BQF6 1/20 0.31
SENP6 Q9GZR1 1/20 0.31
CYP1A2 P05177 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
SCHEMBL6662936 0.91 HSD17B10 (0.41) TRPV4ALDH1A1NPSR1HPGDKDM4E
SCHEMBL6663198 0.89 CYP2A6 (0.38) TRPV4ALDH1A1HPGDCYP1A2NR3C1
SCHEMBL6661253 0.87 TRPV4 (0.40) TRPV4ALDH1A1NPSR1HPGDKDM4E
SCHEMBL6662183 0.85 GPR84 (0.34) ALDH1A1GAAGPR84SENP8SENP7
SCHEMBL6665134 0.83 MAOA (0.35) ALDH1A1MAPTKDM4EGAAGPR84
SCHEMBL6665750 0.82 GPR84 (0.35) ALDH1A1GAAGPR84SENP8SENP7
SCHEMBL6665297 0.81 TSHR (0.44) KMT2AKDM4EGAAHSD17B10NR3C1
SCHEMBL6663209 0.80 GPR84 (0.32) GAAGPR84SENP8SENP7SENP6
SCHEMBL6666946 0.80 CYP2C9 (0.38) ALDH1A1MEN1MAPTKMT2AFFAR4
SCHEMBL6661132 0.80 LPL (0.38) ALDH1A1KDM4EGAAGPR84HSD17B10

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
EP-0893423-B1 LIQUID CRYSTAL COMPOUNDS HAVING FLUORINATED LINKAGES, LIQUID CRYSTAL COMPOSITIONS, AND LIQUID CRYSTAL DISPLAY DEVICES CHISSO CORP (JP) 2004-09-01 EP disclosed