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Sugi Predict / Compounds / SCHEMBL3408698

SCHEMBL3408698

SCHEMBL3408698

Cc1c(N[C@@H](C(=O)N(N)C(=O)c2ccc([N+](=O)[O-])cc2)[C@H](C)O[Si](C)(C)C(C)(C)C)ccc(C#N)c1Cl

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ AR P10275 4/20 0.35
▸ PGR P06401 2/20 0.35
▸ NR3C1 P04150 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ MAPT P10636 1/20 0.30
▸ THRB P10828 1/20 0.30
▸ ADRB2 P07550 1/20 0.30
▸ ADRB1 P08588 1/20 0.30
▸ ADRB3 P13945 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
SCHEMBL1363035 0.84 MEN1 (0.36) ARPGRNR3C1MEN1KMT2A
SCHEMBL1364749 0.84 MEN1 (0.36) ARPGRNR3C1MEN1KMT2A
SCHEMBL1365838 0.84 AR (0.35) ARPGR
SCHEMBL27236963 0.78 AR (0.40) ARPGRNR3C1
SCHEMBL1365692 0.75 AR (0.44) ARPGR
SCHEMBL1365015 0.74 AR (0.42) ARPGRNR3C1
SCHEMBL1365013 0.74 AR (0.42) ARPGRNR3C1
SCHEMBL1363750 0.74 PGR (0.58) ARPGR
SCHEMBL1368160 0.74 PGR (0.58) ARPGR
SCHEMBL15663226 0.74 PGR (0.58) ARPGR

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-2260028-A2 SELECTIVE ANDROGEN RECEPTOR MODULATORS Radius Health, Inc. (US) 2010-12-15 — — EP disclosed
WO-2009105214-A2 SELECTIVE ANDROGEN RECEPTOR MODULATORS RADIUS HEALTH, INC. (US) 2009-08-27 — — WO disclosed