SCHEMBL8065440

SCHEMBL8065440

COc1ccc(CN2C(=O)c3cccnc3C2=O)cc1-c1cccc(NO)c1

nearest known ligand 0.57

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ RXFP1 Q9HBX9 16/20 0.57
▸ HDAC7 Q8WUI4 1/20 0.55
▸ RAB9A P51151 1/20 0.54
▸ KMT2A Q03164 2/20 0.54
▸ MEN1 O00255 1/20 0.54
▸ POLB P06746 1/20 0.52

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
SCHEMBL8066070 0.88 HTT (0.57) RXFP1HDAC7KMT2APOLB
SCHEMBL15906093 0.86 RXFP1 (0.60) RXFP1RAB9AKMT2AMEN1POLB
SCHEMBL8054760 0.84 HDAC7 (0.55) RXFP1HDAC7KMT2AMEN1POLB
SCHEMBL3789304 0.82 L3MBTL1 (0.56) RXFP1RAB9AKMT2AMEN1POLB
SCHEMBL8068535 0.80 HDAC7 (0.49) HDAC7KMT2AMEN1
SCHEMBL8066228 0.80 HTT (0.48) —
SCHEMBL8071515 0.78 HDAC7 (0.45) HDAC7KMT2A
SCHEMBL8053373 0.75 POLB (0.46) KMT2AMEN1POLB
SCHEMBL8064800 0.75 HTT (0.52) KMT2AMEN1
SCHEMBL8033863 0.74 GAA (0.57) HDAC7

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
WO-2009067600-A2 BIARYL PDE4 INHIBITORS FOR TREATING INFLAMMATION DECODE GENETICS EHF (IS) 2009-05-28 — — WO disclosed
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