SCHEMBL13310785

SCHEMBL13310785

Cc1ncc(-c2ccc(-c3ccc(C)c(F)c3F)c(F)c2F)cn1

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ALOX5AP P20292 11/20 0.38
▸ FEN1 P39748 11/20 0.38
▸ NTRK1 P04629 1/20 0.38
▸ PDE3B Q13370 2/20 0.36
▸ PDE3A Q14432 2/20 0.36
▸ ABL1 P00519 2/20 0.36
▸ CYP3A4 P08684 2/20 0.35
▸ CYP2A6 P11509 2/20 0.35
▸ CYP2B6 P20813 2/20 0.35
▸ CYP2C19 P33261 2/20 0.35
▸ GRIN2B Q13224 1/20 0.33

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
SCHEMBL20929592 0.98 ALOX5AP (0.38) ALOX5APFEN1NTRK1PDE3BPDE3A
SCHEMBL13310790 0.89 CYP3A4 (0.37) ALOX5APFEN1NTRK1PDE3BPDE3A
SCHEMBL13310776 0.81 PDE3B (0.39) ALOX5APFEN1PDE3BPDE3ACYP3A4
SCHEMBL19154379 0.79 PTGS2 (0.45) ALOX5APFEN1PDE3BPDE3AABL1
SCHEMBL12023277 0.78 POLB (0.38) —
SCHEMBL18069659 0.78 POLB (0.38) —
SCHEMBL22219385 0.78 PTGS2 (0.40) ALOX5APFEN1PDE3BPDE3AABL1
SCHEMBL803253 0.77 PTGS2 (0.38) ALOX5APFEN1
SCHEMBL4489662 0.77 FEN1 (0.51) ALOX5APFEN1ABL1CYP3A4CYP2A6
SCHEMBL15243549 0.74 PDE3B (0.44) PDE3BPDE3AABL1GRIN2B

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-8405799-B2 Polymer-stabilized liquid crystal composition, liquid crystal display device, method for producing liquid crystal display device DIC CORPORATION (JP) 2013-03-26 — — US disclosed
US-20100149446-A1 POLYMER-STABILIZED LIQUID CRYSTAL COMPOSITION, LIQUID CRYSTAL DISPLAY DEVICE, METHOD FOR PRODUCING LIQUID CRYSTAL DISPLAY DEVICE DIC CORPORATION (JP) 2010-06-17 — — US disclosed
Send feedback