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Sugi Predict / Compounds / SCHEMBL13611162

SCHEMBL13611162

SCHEMBL13611162

COCCNC(=O)Cn1cc(C(O)(CC(F)(F)F)c2ccc3c(cnn3-c3ccc(C)cc3)c2)c2ccccc21

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 2/20 0.43
▸ NR3C1 P04150 4/20 0.41
▸ TSHR P16473 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ ALDH1A1 P00352 2/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ IDO1 P14902 1/20 0.40
▸ KMT2A Q03164 1/20 0.39
▸ SMO Q99835 2/20 0.39
▸ USP2 O75604 1/20 0.38

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
SCHEMBL4281571 0.90 NR3C1 (0.50) POLBNR3C1TSHRSMN1; SMN2ALDH1A1
SCHEMBL13611160 0.90 NR3C1 (0.42) NR3C1SMO
SCHEMBL13611161 0.88 NR3C1 (0.41) NR3C1SMO
SCHEMBL13611164 0.80 NR3C1 (0.45) NR3C1SMO
SCHEMBL4275984 0.79 NR3C1 (0.51) NR3C1SMO
SCHEMBL14606304 0.79 NR3C1 (0.51) NR3C1SMO
SCHEMBL4280121 0.79 NR3C1 (0.54) NR3C1SMO
SCHEMBL4273926 0.79 NR3C1 (0.51) NR3C1SMO
SCHEMBL4277807 0.78 NR3C1 (0.49) NR3C1SMO
SCHEMBL4420922 0.77 NR3C1 (0.48) NR3C1SMO

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
US-7622594-B2 Glucocortioid mimetics, methods of making them, pharmaceutical compositions, and uses thereof BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2009-11-24 — — US disclosed