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Sugi Predict / Compounds / SCHEMBL14044111

SCHEMBL14044111

SCHEMBL14044111

C=Cc1cc(C)c(S(=O)(=O)NC(COc2ccc(Cl)cc2Cl)C(F)(F)F)c(C)c1

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ NR3C1 P04150 12/20 0.50
▸ NR3C2 P08235 10/20 0.50
▸ PGR P06401 8/20 0.50
▸ SLC2A1 P11166 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ PKM P14618 1/20 0.35
▸ TSHR P16473 1/20 0.35
▸ TDP1 Q9NUW8 1/20 0.35

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
SCHEMBL3231139 0.89 NR3C1 (0.64) NR3C1NR3C2PGR
SCHEMBL3221854 0.81 NR3C1 (0.65) NR3C1NR3C2PGRALDH1A1PKM
SCHEMBL3228847 0.80 NR3C1 (0.64) NR3C1NR3C2PGR
SCHEMBL3222702 0.79 NR3C1 (0.62) NR3C1NR3C2PGR
SCHEMBL14044210 0.79 NR3C2 (0.39) NR3C1NR3C2PGR
SCHEMBL3226696 0.79 NR3C1 (0.65) NR3C1NR3C2PGR
SCHEMBL3219841 0.77 NR3C1 (0.59) NR3C1NR3C2PGR
SCHEMBL3213758 0.77 NR3C1 (0.65) NR3C1NR3C2PGR
SCHEMBL14044318 0.76 NR3C2 (0.40) NR3C1NR3C2PGR
SCHEMBL3224872 0.74 NR3C1 (0.78) NR3C1NR3C2PGR

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-2008124745-A1 GLUCOCORTICOID MIMETICS, METHODS OF MAKING THEM, PHARMACEUTICAL COMPOSITIONS, AND USES THEREOF BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2008-10-16 — — WO disclosed