SCHEMBL10155141

SCHEMBL10155141

N#Cc1ccc(NC=S)cc1C(F)(F)F

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SLC22A12 Q96S37 1/20 0.51
TAS2R14 Q9NYV8 1/20 0.49
AR P10275 13/20 0.49
PGR P06401 1/20 0.47
TRPA1 O75762 1/20 0.45
NTSR1 P30989 1/20 0.44
VCP P55072 1/20 0.44
ABCG2 Q9UNQ0 1/20 0.44

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
SCHEMBL20040969 0.83 SLC22A12 (0.55) SLC22A12TAS2R14ARTRPA1
SCHEMBL8210097 0.79 SLC22A12 (0.54) SLC22A12TAS2R14ARPGRTRPA1
SCHEMBL2973749 0.79 AR (0.54) SLC22A12TAS2R14ARPGRTRPA1
SCHEMBL20179096 0.79 SLC22A12 (0.54) SLC22A12TAS2R14ARPGRTRPA1
SCHEMBL16946784 0.79 AR (0.52) SLC22A12TAS2R14AR
SCHEMBL17227549 0.78 ALDH1A1 (0.40) ABCG2
Hydrochloric Acid SCHEMBL552509 0.78 SLC22A12 (0.52) SLC22A12TAS2R14ARPGRTRPA1
SCHEMBL16823496 0.78 TAS2R14 (0.53) SLC22A12TAS2R14AR
SCHEMBL3054694 0.77 SLC22A12 (0.55) SLC22A12TAS2R14ARPGR
SCHEMBL14919155 0.77 SLC22A12 (0.55) SLC22A12TAS2R14ARTRPA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170174635-A1 PROCESS FOR THE PREPARATION OF ENZALUTAMIDE RANBAXY LABORATORIES LIMITED (IN) 2017-06-22 US disclosed
EP-3020706-A1 DIARYLTHIOHYDANTOIN COMPOUNDS USEFUL FOR THE TREATMENT OF A HYPERPROLIFERATIVE DISORDER THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2016-05-18 EP disclosed
EP-1893196-B1 DIARYLHYDANTOIN COMPOUND UNIV CALIFORNIA (US) 2012-01-18 EP 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-20170174635-A1 PROCESS FOR THE PREPARATION OF ENZALUTAMIDE AR, KLK3, KLK5 SLC22A12 4607/4885TAS2R14 4696/4885AR 1/4885

“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.