SCHEMBL13070686

SCHEMBL13070686

CC(C)CN(CC(=O)Nc1ccccc1)c1ccc(C#N)c(C(F)(F)F)c1

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
RORC P51449 1/20 0.48
AR P10275 7/20 0.48
PGR P06401 1/20 0.48
UBE2M P61081 1/20 0.44
DCUN1D1 Q96GG9 1/20 0.44
TAS2R14 Q9NYV8 1/20 0.43

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
SCHEMBL13070775 0.91 AR (0.53) RORCARPGR
SCHEMBL3419402 0.88 AR (0.49) RORCARPGRUBE2MDCUN1D1
SCHEMBL13326442 0.87 AR (0.53) RORCARPGR
SCHEMBL3417903 0.86 AR (0.50) RORCARPGRTAS2R14
SCHEMBL3289697 0.85 AR (0.55) ARPGRTAS2R14
SCHEMBL13070772 0.83 AR (0.45) RORCARPGRUBE2MDCUN1D1
SCHEMBL13029925 0.82 KMT2A (0.41) AR
SCHEMBL3289642 0.82 AR (0.54) ARPGR
SCHEMBL3419674 0.80 AR (0.57) ARPGR
SCHEMBL3416488 0.78 AR (0.51) RORCARPGR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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

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 RORC 50/4885AR 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.