SCHEMBL14062887

SCHEMBL14062887

Fc1ccc(-c2ccc(C3CCC(C4CCC(OCC5CO5)CC4)CC3)cc2)cc1F

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ HCRTR2 O43614 4/20 0.37
▸ USP5 P45974 2/20 0.32
▸ NAAA Q02083 1/20 0.31
▸ HDAC6 Q9UBN7 1/20 0.31
▸ GPR119 Q8TDV5 1/20 0.30
▸ CYP17A1 P05093 1/20 0.30
▸ CYP11B1 P15538 1/20 0.30
▸ CYP11B2 P19099 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
SCHEMBL14062787 0.96 HCRTR2 (0.38) HCRTR2USP5NAAACYP17A1CYP11B1
SCHEMBL14062895 0.91 HCRTR2 (0.33) HCRTR2
SCHEMBL14062780 0.90 HCRTR2 (0.43) HCRTR2USP5HDAC6
SCHEMBL14062893 0.88 HCRTR2 (0.39) HCRTR2USP5NAAAGPR119
SCHEMBL14062838 0.87 HCRTR2 (0.34) HCRTR2NAAA
SCHEMBL14063176 0.87 HCRTR2 (0.37) HCRTR2NAAAGPR119
SCHEMBL14062796 0.86 HCRTR2 (0.32) HCRTR2NAAA
SCHEMBL14062607 0.86 HCRTR2 (0.45) HCRTR2USP5HDAC6
SCHEMBL14062803 0.83 HCRTR2 (0.40) HCRTR2USP5NAAA
SCHEMBL14062735 0.83 HCRTR2 (0.40) HCRTR2USP5GPR119

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-7425354-B2 Photopolymerizable liquid crystal composition, its polymer or polymer composition, and optical compensation element CHISSO CORPORATION (JP) 2008-09-16 — — US disclosed
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