SCHEMBL21789050

SCHEMBL21789050

CCOC(=O)CCCOc1ccccc1C(N)C(=O)N(CC(=O)OCC)Cc1cccs1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 13/20 0.46
ALDH1A1 P00352 4/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
POLB P06746 3/20 0.41
MAPT P10636 3/20 0.41
NPSR1 Q6W5P4 2/20 0.41
TSHR P16473 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
PKM P14618 1/20 0.38
RECQL P46063 1/20 0.38

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
SCHEMBL24002470 0.90 TRPM8 (0.46) TRPM8ALDH1A1SMN1; SMN2POLBMAPT
SCHEMBL24002418 0.89 MAPT (0.51) TRPM8ALDH1A1SMN1; SMN2POLBMAPT
SCHEMBL21789052 0.88 TRPM8 (0.44) TRPM8ALDH1A1SMN1; SMN2POLBMAPT
SCHEMBL21789058 0.87 PPARG (0.47) TRPM8ALDH1A1SMN1; SMN2POLBMAPT
SCHEMBL21789268 0.87 PPARG (0.47) TRPM8ALDH1A1SMN1; SMN2POLBMAPT
SCHEMBL21789284 0.87 PPARG (0.47) TRPM8ALDH1A1SMN1; SMN2POLBMAPT
SCHEMBL21789053 0.84 POLB (0.46) TRPM8ALDH1A1POLBMAPTNPSR1
SCHEMBL21777274 0.83 ALDH1A1 (0.41) TRPM8ALDH1A1SMN1; SMN2POLBMAPT
SCHEMBL21789056 0.81 POLB (0.46) TRPM8ALDH1A1SMN1; SMN2POLBMAPT
SCHEMBL21789051 0.81 POLB (0.46) TRPM8ALDH1A1SMN1; SMN2POLBMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210346367-A1 O-GLCNAC TRANSFERASE INHIBITORS AND USES THEREOF PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2021-11-11 US disclosed
WO-2020047251-A1 O-GLCNAC TRANSFERASE INHIBITORS AND USES THEREOF PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2020-03-05 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-20210346367-A1 O-GLCNAC TRANSFERASE INHIBITORS AND USES THEREOF OGT, OGA, UGGT1 TRPM8 3740/4885ALDH1A1 1594/4885SMN1; SMN2 3231/4885

“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.