SCHEMBL20021416

SCHEMBL20021416

CC(C)(C)OC(=O)N[C@@H](C(=O)CO)c1ccc(F)cc1

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CTSS P25774 4/20 0.48
CTSK P43235 4/20 0.48
SCN9A Q15858 2/20 0.41
S1PR3 Q99500 1/20 0.41
TSHR P16473 3/20 0.40
CYP2C9 P11712 2/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
MAPT P10636 1/20 0.40
CYP2C19 P33261 1/20 0.40
MEN1 O00255 1/20 0.39
LMNA P02545 1/20 0.39
KMT2A Q03164 1/20 0.39
HTT P42858 1/20 0.38
ATM Q13315 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA7 P43166 1/20 0.37
ACE P12821 1/20 0.37

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
SCHEMBL6895179 0.86 CTSK (0.64) CTSSCTSKS1PR3MAPTATM
SCHEMBL16171661 0.85 CTSS (0.49) CTSSCTSKSCN9AS1PR3TSHR
SCHEMBL16174131 0.85 CTSS (0.49) CTSSCTSKSCN9AS1PR3TSHR
SCHEMBL16171646 0.84 CTSK (0.44) CTSSCTSKS1PR3TSHRCYP2C9
SCHEMBL4815779 0.84 CTSS (0.51) CTSSCTSKS1PR3TSHRCYP2C9
SCHEMBL266706 0.84 CTSS (0.51) CTSSCTSKS1PR3TSHRCYP2C9
SCHEMBL1162807 0.84 CTSS (0.51) CTSSCTSKS1PR3TSHRCYP2C9
SCHEMBL16171656 0.83 CTSS (0.45) CTSSCTSKSCN9AS1PR3TSHR
SCHEMBL17723343 0.83 CTSS (0.47) CTSSCTSKSCN9AS1PR3TSHR
SCHEMBL27813793 0.83 CTSS (0.47) CTSSCTSKSCN9AS1PR3TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180093967-A1 POTENT GAMMA-SECRETASE MODULATORS THE GENERAL HOSPITAL CORPORATION 2018-04-05 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-20180093967-A1 POTENT GAMMA-SECRETASE MODULATORS BACE1, BACE2, APP CTSS 111/4885CTSK 218/4885SCN9A 662/4885

“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.