SCHEMBL10072559

SCHEMBL10072559

Cc1cc(N2C(=O)C3(CCC3)N(c3ccc(CCCC(=O)Nc4ccc(C#N)c(C(F)(F)F)c4)cc3)C2=S)ccc1C#N

nearest known ligand 0.59

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
AR P10275 20/20 0.59
NR3C1 P04150 1/20 0.52
HDAC1 Q13547 4/20 0.48

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
SCHEMBL2633035 0.95 AR (0.63) ARNR3C1HDAC1
SCHEMBL15468236 0.90 AR (0.59) ARNR3C1HDAC1
SCHEMBL13973946 0.89 AR (0.51) ARNR3C1HDAC1
SCHEMBL30184873 0.88 AR (0.76) ARNR3C1HDAC1
SCHEMBL547082 0.88 AR (0.76) ARNR3C1HDAC1
SCHEMBL11892452 0.86 AR (0.77) AR
SCHEMBL10073489 0.86 AR (0.64) ARNR3C1
SCHEMBL1715961 0.85 AR (0.64) ARNR3C1HDAC1
SCHEMBL29508773 0.85 AR (0.64) ARNR3C1HDAC1
SCHEMBL1715648 0.85 AR (0.75) ARNR3C1HDAC1

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-8110594-B2 Diarylthiohydantoin compounds THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2012-02-07 US disclosed
US-20080139634-A2 Use against hormone refractory prostate cancer; 1-(3-trifluoromethyl-4-cyanophenyl)-2-thioxo-3-(substituted phenyl)-imidazolidin-5-one and spiro ring derivatives thereof; androgen receptor antagonists with minimal agonist activity REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2008-06-12 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-20080139634-A2 Use against hormone refractory prostate cancer; 1-(3-trifluoromethyl-4-cyanophenyl)-2-thioxo-3-(substituted phenyl)-imidazolidin-5-one and spiro ring derivatives thereof; androgen receptor antagonists with minimal agonist activity AR, LHCGR, KLK3 AR 1/4885NR3C1 37/4885HDAC1 204/4885

“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.