SCHEMBL13347782

SCHEMBL13347782

Cc1ccc(-c2cnc(-c3ccc(OCCCCC(C)C)cc3F)nc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ RARB P10826 1/20 0.45
▸ CYP2C9 P11712 5/20 0.40
▸ MOGAT2 Q3SYC2 5/20 0.40
▸ HTR1A P08908 1/20 0.36
▸ HTR1D P28221 1/20 0.36
▸ HTR1B P28222 1/20 0.36
▸ GRM5 P41594 1/20 0.36
▸ HRH3 Q9Y5N1 2/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.34
▸ LTB4R Q15722 1/20 0.34
▸ DPP4 P27487 4/20 0.34
▸ GRIN2B Q13224 1/20 0.34
▸ MGAT2 Q10469 2/20 0.34
▸ PDK2 Q15119 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
SCHEMBL13347780 0.89 CYP2C9 (0.38) RARBCYP2C9MOGAT2GRM5HRH3
SCHEMBL14802206 0.84 RARB (0.46) RARBHTR1AHTR1DHTR1B
SCHEMBL14802203 0.77 RARB (0.44) RARB
SCHEMBL14802205 0.77 RARB (0.44) RARB
SCHEMBL13310774 0.76 MAP4K4 (0.39) GRM5NPSR1
SCHEMBL16187781 0.75 RARB (0.52) RARB
SCHEMBL18590717 0.75 RARB (0.52) RARB
SCHEMBL8984168 0.75 RARB (0.52) RARB
SCHEMBL16187780 0.75 RARB (0.52) RARB
SCHEMBL10652587 0.75 LNPEP (0.35) RARBHTR1AHTR1DHTR1BPDK2

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-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
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