SCHEMBL20006746

SCHEMBL20006746

Cc1cc(-c2ccc(-c3ccccc3F)cc2F)cc(F)c1C#Cc1cc(F)c(-c2cc(F)c(F)c(F)c2)c(F)c1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TNKS O95271 1/20 0.40
TNKS2 Q9H2K2 1/20 0.40
PTPRC P08575 1/20 0.35
PTPN1 P18031 1/20 0.35
FEN1 P39748 7/20 0.35
ALOX5AP P20292 4/20 0.35
DHODH Q02127 2/20 0.34
TRPA1 O75762 1/20 0.32
PDK2 Q15119 1/20 0.32
XIAP P98170 1/20 0.31
BIRC2 Q13490 1/20 0.31
PDE3B Q13370 3/20 0.31
PDE3A Q14432 3/20 0.31
PGR P06401 2/20 0.31
ACMSD Q8TDX5 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
SCHEMBL20006757 0.95 TNKS (0.40) TNKSTNKS2PTPRCPTPN1FEN1
SCHEMBL20006943 0.91 TNKS (0.40) TNKSTNKS2PTPRCPTPN1FEN1
SCHEMBL20004915 0.89 PDE3B (0.33) PDE3BPDE3A
SCHEMBL20005252 0.88 PDE3B (0.33) PDE3BPDE3A
SCHEMBL20005243 0.87 PDE9A (0.33) PDE3BPDE3A
SCHEMBL20006668 0.87 MEN1 (0.35) TNKSTNKS2FEN1ALOX5APDHODH
SCHEMBL20005288 0.85 PDE3B (0.32) PDE3BPDE3A
SCHEMBL20005289 0.84 AKR1C3 (0.33) PDE3BPDE3A
SCHEMBL20006922 0.83 MEN1 (0.39) TNKSTNKS2FEN1ALOX5AP
SCHEMBL20004910 0.82 GRM5 (0.33) PDE3BPDE3A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10208249-B2 Liquid crystal compound, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2019-02-19 US disclosed
US-20180086979-A1 LIQUID CRYSTAL COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORPORATION (JP) 2018-03-29 US disclosed