SCHEMBL19348989

SCHEMBL19348989

CC(C)(C)OC(=O)N[C@H](C=O)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CTSK P43235 8/20 0.52
CTSS P25774 4/20 0.52
MAPT P10636 1/20 0.49
ATM Q13315 1/20 0.49
GABRB1 P18505 1/20 0.46
GABRB2 P47870 1/20 0.46
CTSL P07711 1/20 0.44
CTSB P07858 1/20 0.44
PPARA Q07869 2/20 0.43
PPARG P37231 1/20 0.43

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
SCHEMBL4715202 1.00 CTSK (0.52) CTSKCTSSMAPTATMGABRB1
SCHEMBL10896010 1.00 CTSK (0.52) CTSKCTSSMAPTATMGABRB1
SCHEMBL30109141 0.87 MAPT (0.50) CTSKCTSSMAPTATMGABRB1
SCHEMBL13920479 0.86 MIF (0.48) CTSKCTSSMAPTATMPPARA
SCHEMBL13412306 0.86 MAPT (0.54) CTSKCTSSMAPTATMGABRB1
SCHEMBL15952332 0.85 TRPA1 (0.45) CTSKCTSSMAPTATMPPARA
SCHEMBL14847516 0.85 TRPA1 (0.45) CTSKCTSSMAPTATMPPARA
SCHEMBL10154459 0.85 NPC1 (0.49) CTSKCTSSMAPTATM
SCHEMBL13584754 0.85 CTSK (0.46) CTSKCTSSMAPTATMGABRB1
SCHEMBL13584755 0.85 CTSK (0.46) CTSKCTSSMAPTATMGABRB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed
EP-3233859-B1 BRIDGED PYRAZOLOPYRIDINE DERIVATIVES AS ERK INHIBITORS USEFUL FOR THE TREATEMENT OF CANCER MERCK SHARP & DOHME (US) 2019-08-07 EP disclosed
US-9988397-B2 ERK inhibitors MERCK SHARP & DOHME CORP. (US) 2018-06-05 US disclosed
US-20170267695-A1 ERK INHIBITORS MERCK SHARP & DOHME CORP. (US) 2017-09-21 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-20170267695-A1 ERK INHIBITORS MAPK1, MAP3K1, MAPK4 CTSK 2212/4885CTSS 2646/4885MAPT 4135/4885

“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.