SCHEMBL27477419

SCHEMBL27477419

CNC1=CC(NC)(NC)Nc2ccc(-c3cccc(S(C)(=O)=O)c3)cc21

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ BRD4 O60885 1/20 0.36
▸ CREBBP Q92793 1/20 0.36
▸ PLK4 O00444 2/20 0.36
▸ CAMKK2 Q96RR4 2/20 0.36
▸ NR1H2 P55055 2/20 0.35
▸ NR1H3 Q13133 1/20 0.35
▸ NPY5R Q15761 1/20 0.35
▸ LRRK2 Q5S007 1/20 0.35
▸ TBK1 Q9UHD2 1/20 0.35
▸ ABL1 P00519 1/20 0.35
▸ PGR P06401 3/20 0.34
▸ GRK6 P43250 1/20 0.34
▸ PDPK1 O15530 1/20 0.34
▸ KCNH2 Q12809 2/20 0.34
▸ TDP2 O95551 1/20 0.34
▸ LIMK1 P53667 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
SCHEMBL27492595 0.82 PGR (0.50) PGRTDP2
SCHEMBL27479855 0.78 PGR (0.60) PGRTDP2
SCHEMBL27556573 0.77 PGR (0.33) PGR
SCHEMBL27473389 0.76 TDP2 (0.43) LRRK2TBK1ABL1TDP2LIMK1
SCHEMBL27475516 0.75 PDE3B (0.43) ABL1PGRPDPK1
SCHEMBL27475517 0.74 DYRK1A (0.34) PGR
SCHEMBL27491175 0.74 PGR (0.46) PGRPDPK1TDP2
SCHEMBL4172083 0.73 PGR (0.67) PGR
SCHEMBL27610141 0.70 MEN1 (0.37) PDPK1
SCHEMBL27491886 0.70 PGR (0.58) PGR

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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