SCHEMBL3203290

SCHEMBL3203290

CC[C@@H](CNc1ccc2c(c1)COC2=O)NS(=O)(=O)c1c(N)cc(Cl)cc1Cl

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 7/20 0.47
NR3C2 P08235 6/20 0.47
CYP3A4 P08684 3/20 0.47
PGR P06401 3/20 0.46
ALDH1A1 P00352 3/20 0.39
KDM4E B2RXH2 2/20 0.39
PKM P14618 2/20 0.39
MAPT P10636 4/20 0.39
NPC1 O15118 1/20 0.37
GAA P10253 2/20 0.35
LMNA P02545 1/20 0.35
MAOA P21397 1/20 0.35
MAOB P27338 1/20 0.35
PRF1 P14222 1/20 0.34
CCR10 P46092 1/20 0.33

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
SCHEMBL4551721 0.72 NR3C1 (0.52) NR3C1NR3C2CYP3A4PGR
SCHEMBL13493343 0.72 NR3C1 (0.59) NR3C1NR3C2CYP3A4PGR
SCHEMBL3220259 0.72 NR3C1 (0.59) NR3C1NR3C2CYP3A4PGR
SCHEMBL3213859 0.71 NR3C1 (0.54) NR3C1NR3C2CYP3A4PGR
SCHEMBL3260372 0.70 NR3C1 (0.49) NR3C1NR3C2CYP3A4PGR
SCHEMBL3203403 0.70 NR3C1 (0.49) NR3C1NR3C2CYP3A4PGR
SCHEMBL3203485 0.69 NR3C1 (0.52) NR3C1NR3C2CYP3A4PGR
SCHEMBL14044320 0.68 NR3C1 (0.50) NR3C1NR3C2CYP3A4PGRCCR10
SCHEMBL3774732 0.64 NR3C1 (1.00) NR3C1NR3C2CYP3A4PGRALDH1A1
SCHEMBL3778144 0.63 NR3C1 (0.78) NR3C1NR3C2CYP3A4PGRCCR10

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100063282-A1 Glucocorticoid Mimetics, Methods of Making Them, Pharmaceutical Compositions, and Uses Thereof BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-03-11 US claimed
EP-2136634-A1 GLUCOCORTICOID MIMETICS, METHODS OF MAKING THEM, PHARMACEUTICAL COMPOSITIONS, AND USES THEREOF Boehringer Ingelheim International GmbH (DE) 2009-12-30 EP claimed
WO-2008124665-A1 GLUCOCORTICOID MIMETICS, METHODS OF MAKING THEM, PHARMACEUTICAL COMPOSITIONS, AND USES THEREOF BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2008-10-16 WO claimed
US-20100063282-A1 Glucocorticoid Mimetics, Methods of Making Them, Pharmaceutical Compositions, and Uses Thereof BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-03-11 US disclosed
US-20100063282-A1 Glucocorticoid Mimetics, Methods of Making Them, Pharmaceutical Compositions, and Uses Thereof BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-03-11 US disclosed
US-20100063282-A1 Glucocorticoid Mimetics, Methods of Making Them, Pharmaceutical Compositions, and Uses Thereof BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-03-11 US disclosed
WO-2008124665-A1 GLUCOCORTICOID MIMETICS, METHODS OF MAKING THEM, PHARMACEUTICAL COMPOSITIONS, AND USES THEREOF BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2008-10-16 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100063282-A1 Glucocorticoid Mimetics, Methods of Making Them, Pharmaceutical Compositions, and Uses Thereof NR3C1, MC2R, NR3C2 NR3C1 1/4885NR3C2 3/4885CYP3A4 555/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.