SCHEMBL13625394

SCHEMBL13625394

CCOC(=O)[C@](O)(c1ccc(F)cc1)C(F)(F)F

nearest known ligand 0.66

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.66
HTT P42858 1/20 0.61
MAPK1 P28482 4/20 0.55
MAPT P10636 4/20 0.55
NPSR1 Q6W5P4 2/20 0.55
LMNA P02545 2/20 0.54
KDM4E B2RXH2 1/20 0.54
GAA P10253 1/20 0.54

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
SCHEMBL30031981 1.00 TSHR (0.66) TSHRHTTMAPK1MAPTNPSR1
SCHEMBL3618153 0.89 TSHR (0.68) TSHRHTTMAPK1MAPTNPSR1
SCHEMBL31079057 0.86 TSHR (0.64) TSHRHTTMAPK1MAPTNPSR1
SCHEMBL866071 0.86 TSHR (0.64) TSHRHTTMAPK1MAPTNPSR1
SCHEMBL31079023 0.86 TSHR (0.64) TSHRHTTMAPK1MAPTNPSR1
SCHEMBL6925841 0.85 TSHR (0.63) TSHRHTTMAPK1MAPTNPSR1
SCHEMBL19425510 0.83 TSHR (0.61) TSHRHTTMAPK1MAPTNPSR1
SCHEMBL2396473 0.81 MAPT (0.50) TSHRHTTMAPK1MAPTNPSR1
SCHEMBL19183403 0.80 MAPT (0.49) TSHRHTTMAPK1MAPTNPSR1
SCHEMBL29571318 0.79 MAPT (0.46) TSHRHTTMAPK1MAPTNPSR1

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-20090275515-A1 2-HYDROXY-2-PHENYLTHIOPHENYLPROPIONAMIDES AS ANDROGEN RECEPTOR MODULATORS MERCK SHARP & DOHME CORP. 2009-11-05 US disclosed
US-20090275515-A1 2-HYDROXY-2-PHENYLTHIOPHENYLPROPIONAMIDES AS ANDROGEN RECEPTOR MODULATORS MERCK SHARP & DOHME CORP. 2009-11-05 US disclosed
WO-2008048540-A2 2-HYDROXY-2-PHENYL/THIOPHENYL PROPIONAMIDES AS ANDROGEN RECEPTOR MODULATORS MERCK & CO., INC. (US) 2008-04-24 WO 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-20090275515-A1 2-HYDROXY-2-PHENYLTHIOPHENYLPROPIONAMIDES AS ANDROGEN RECEPTOR MODULATORS SHBG, AR, FSHR TSHR 401/4885HTT 327/4885MAPK1 3437/4885

“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.