SCHEMBL12960442

SCHEMBL12960442

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

nearest known ligand 0.48

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ AR P10275 19/20 0.45
▸ PGR P06401 1/20 0.41

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
SCHEMBL21936494 0.81 AR (0.47) ARPGR
SCHEMBL4404032 0.79 AR (0.51) ARPGR
SCHEMBL21936738 0.78 AR (0.49) ARPGR
SCHEMBL16471305 0.76 TRPV4 (0.44) AR
SCHEMBL189787 0.76 AR (0.49) ARPGR
SCHEMBL16471313 0.76 EPAS1 (0.33) —
SCHEMBL16471349 0.76 — —
SCHEMBL4402110 0.76 AR (0.51) ARPGR
SCHEMBL18856260 0.76 AR (0.51) ARPGR
SCHEMBL16130164 0.74 AR (0.50) ARPGR

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-20180148416-A1 INDUSTRIAL PROCESS FOR THE PREPARATION OF ENZALUTAMIDE OLON S.P.A. (IT) 2018-05-31 — — US disclosed
US-20160016925-A1 Substituted (R)-3-(4-methylcarbamoyl-3-fluorophenylamino)tetrahydrofuran-3-encarboxylic acid (variants) and ester thereof, method for preparation and use Ivachtchenko, Alexandre Vasilievich (US) 2016-01-21 — — US disclosed
US-20120251551-A1 Substituted (Heteroarylmethyl)thiohydantoins BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2012-10-04 — — 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 (3 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-20120251551-A1 Substituted (Heteroarylmethyl)thiohydantoins TPMT, BPHL, VHL AR 58/4885PGR 1590/4885
US-20160016925-A1 Substituted (R)-3-(4-methylcarbamoyl-3-fluorophenylamino)tetrahydrofuran-3-encarboxylic acid (variants) and ester thereof, method for preparation and use AR, SRD5A1, CYP19A1 AR 1/4885PGR 263/4885
US-20180148416-A1 INDUSTRIAL PROCESS FOR THE PREPARATION OF ENZALUTAMIDE AR, HDAC11, HDAC1 AR 1/4885PGR 2472/4885

“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.

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