SCHEMBL16095040

SCHEMBL16095040

N#Cc1ccnc(-c2c[nH]c(CC(F)(F)F)n2)c1

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ NPY5R Q15761 10/20 0.36
▸ KCNH2 Q12809 5/20 0.36
▸ MAP3K14 Q99558 1/20 0.35
▸ USP30 Q70CQ3 2/20 0.33
▸ HCRTR1 O43613 2/20 0.33
▸ HCRTR2 O43614 2/20 0.33
▸ HTR1A P08908 1/20 0.33
▸ PRKD1 Q15139 2/20 0.33
▸ PRKD2 Q9BZL6 2/20 0.33
▸ METAP2 P50579 1/20 0.32
▸ METAP1 P53582 1/20 0.32
▸ SYK P43405 1/20 0.31

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
SCHEMBL16095164 0.79 HCRTR1 (0.40) NPY5RKCNH2HCRTR1HCRTR2HTR1A
SCHEMBL16095234 0.78 PHF8 (0.40) HTR1A
SCHEMBL16095484 0.78 USP30 (0.38) NPY5RKCNH2MAP3K14USP30PRKD1
SCHEMBL16095263 0.77 PHF8 (0.39) NPY5RKCNH2HCRTR1HCRTR2
SCHEMBL16095271 0.76 NPY5R (0.34) NPY5RKCNH2USP30METAP2METAP1
SCHEMBL16094887 0.76 TSHR (0.37) NPY5RKCNH2MAP3K14
SCHEMBL16095102 0.76 PHF8 (0.41) NPY5R
SCHEMBL16095001 0.75 TAAR1 (0.44) NPY5RKCNH2MAP3K14METAP2METAP1
SCHEMBL16095691 0.75 FAAH (0.46) PRKD1PRKD2METAP2METAP1
SCHEMBL17604641 0.75 MAP3K14 (0.39) NPY5RKCNH2MAP3K14USP30PRKD1

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
EP-2969007-A1 HISTONE DEMETHYLASE INHIBITORS Quanticel Pharmaceuticals Inc (US) 2016-01-20 — — EP disclosed
WO-2014151945-A1 HISTONE DEMETHYLASE INHIBITORS Quanticel Pharmaceuticals, Inc. (US) 2014-09-25 — — WO disclosed
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