SCHEMBL27494363

SCHEMBL27494363

CNC1=CC(NC)(NC)Nc2ccc(-c3cccc([N+](=O)[O-])c3)c(Cl)c21

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ PGR P06401 9/20 0.44
▸ TDP2 O95551 3/20 0.38
▸ GSK3A P49840 2/20 0.36
▸ GSK3B P49841 2/20 0.36
▸ NR3C1 P04150 1/20 0.35
▸ NR3C2 P08235 1/20 0.35
▸ AR P10275 1/20 0.35
▸ MEN1 O00255 2/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ AKR1C3 P42330 1/20 0.35
▸ AKR1C2 P52895 1/20 0.35
▸ NPC1 O15118 1/20 0.34
▸ POLB P06746 1/20 0.34

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
SCHEMBL27474213 0.82 PGR (0.43) PGRTDP2GSK3AGSK3BMEN1
SCHEMBL27479855 0.82 PGR (0.60) PGRTDP2MEN1KMT2ANPC1
SCHEMBL4172186 0.78 PGR (0.66) PGRNR3C1NR3C2AR
SCHEMBL27477006 0.77 PGR (0.46) PGRTDP2GSK3AGSK3BALDH1A1
SCHEMBL27493196 0.74 PGR (0.45) PGRTDP2GSK3BALDH1A1NPC1
SCHEMBL27474216 0.73 PGR (0.46) PGRTDP2GSK3BAKR1C3AKR1C2
SCHEMBL27491175 0.71 PGR (0.46) PGRTDP2GSK3AGSK3BAR
SCHEMBL5502297 0.66 PGR (0.56) PGRTDP2NR3C1NR3C2AR
SCHEMBL5505164 0.65 PGR (0.54) PGRTDP2NR3C1NR3C2AR
SCHEMBL4174299 0.63 PGR (0.71) PGRNR3C1NR3C2ARALDH1A1

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-1172917-C Steroid receptor modulator compounds and methods ��λ��ҩ��ɷ����޹�˾ 2004-10-27 — — CN claimed
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