SCHEMBL3415475

SCHEMBL3415475

CC(=O)Nc1ccc(S(=O)(=O)CCN(CC(F)(F)F)c2ccc(C#N)c(C(F)(F)F)c2)cc1

nearest known ligand 0.58

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PLA2G7 Q13093 2/20 0.51
AR P10275 6/20 0.51
PGR P06401 2/20 0.49
CYP2C19 P33261 1/20 0.49
ABCB11 O95342 1/20 0.49
ALB P02768 1/20 0.49
ADRA2C P18825 1/20 0.49
GHSR Q92847 1/20 0.49
TP53 P04637 1/20 0.47

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
SCHEMBL3419296 0.87 AR (0.48) PLA2G7ARPGRCYP2C19ABCB11
SCHEMBL3418830 0.84 AR (0.48) ARPGRCYP2C19ABCB11ALB
SCHEMBL3419693 0.83 AR (0.48) PLA2G7ARPGRCYP2C19ABCB11
SCHEMBL3416488 0.83 AR (0.51) PLA2G7ARPGR
SCHEMBL13029863 0.83 MAPT (0.41) TP53
SCHEMBL3415897 0.83 AR (0.48) ARPGR
SCHEMBL3419404 0.83 PLA2G7 (0.49) PLA2G7ARPGRCYP2C19
SCHEMBL3417012 0.82 PLA2G7 (0.49) PLA2G7ARPGRCYP2C19
SCHEMBL3416052 0.80 AR (0.46) PLA2G7ARPGRCYP2C19ABCB11
SCHEMBL3418840 0.79 AR (0.45) PLA2G7ARPGR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080255124-A1 Chemical Compounds SMITHKLINE BEECHAM CORPORATION (US) 2008-10-16 US claimed
US-7834063-B2 4-[(Cyclopropylmethyl)(2-{[4-(1,1-dimethylethyl)phenyl]oxy}ethyl)amino]-2-(trifluoromethyl)benzonitrile; modulators of androgen, glucocorticoid, mineralocorticoid, and progesterone receptors; osteoporosis, muscle wasting,endometriosis, cardiovascular disease; breast, uterine cancer, prostatic hyperplasia GLAXOSMITHKLINE LLC (US) 2010-11-16 US disclosed
US-7834063-B2 4-[(Cyclopropylmethyl)(2-{[4-(1,1-dimethylethyl)phenyl]oxy}ethyl)amino]-2-(trifluoromethyl)benzonitrile; modulators of androgen, glucocorticoid, mineralocorticoid, and progesterone receptors; osteoporosis, muscle wasting,endometriosis, cardiovascular disease; breast, uterine cancer, prostatic hyperplasia GLAXOSMITHKLINE LLC (US) 2010-11-16 US disclosed
US-20080255124-A1 Chemical Compounds SMITHKLINE BEECHAM CORPORATION (US) 2008-10-16 US disclosed
US-20080255124-A1 Chemical Compounds SMITHKLINE BEECHAM CORPORATION (US) 2008-10-16 US 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-20080255124-A1 Chemical Compounds NR3C2, NR5A1, NR3C1 PLA2G7 2046/4885AR 4/4885PGR 27/4885

“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.