SCHEMBL27957178

SCHEMBL27957178

O=CC1NCN(c2ccc3[nH]cnc3c2)C1c1cc(F)cc(F)c1F

nearest known ligand 0.46

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ QPCT Q16769 7/20 0.46
▸ HSD11B1 P28845 2/20 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
SCHEMBL27957173 0.79 QPCT (0.39) QPCT
SCHEMBL1444013 0.77 QPCT (0.55) QPCTHSD11B1
SCHEMBL29410497 0.77 QPCT (0.55) QPCTHSD11B1
SCHEMBL12274018 0.71 QPCT (0.85) QPCTHSD11B1
SCHEMBL12456212 0.69 QPCT (0.69) QPCT
SCHEMBL12273851 0.68 QPCT (0.56) QPCT
SCHEMBL4299934 0.67 QPCT (0.55) QPCT
SCHEMBL15682357 0.66 QPCT (0.45) QPCT
SCHEMBL12456207 0.66 QPCT (0.56) QPCT
SCHEMBL12274270 0.66 QPCT (0.54) QPCT

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
CN-102695546-B Heterocylcic derivatives as inhibitors of glutaminyl cyclase PROBIODRUG AG 2014-09-10 — — CN claimed
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