SCHEMBL1701587

SCHEMBL1701587

C=C(C)[C@@H](O)C(CCc1ccccc1)NC(=O)OCc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CTSL P07711 11/20 0.51
CTSB P07858 2/20 0.49
TRPM8 Q7Z2W7 1/20 0.48
ATM Q13315 1/20 0.46
CTRB1 P17538 2/20 0.46
CASP1 P29466 2/20 0.46
CTSS P25774 1/20 0.46
ALDH1A1 P00352 1/20 0.46
ALOX15 P16050 1/20 0.46
CTSK P43235 2/20 0.44

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
SCHEMBL1701841 1.00 CTSL (0.51) CTSLCTSBTRPM8ATMCTRB1
SCHEMBL1709155 1.00 CTSL (0.51) CTSLCTSBTRPM8ATMCTRB1
SCHEMBL8100463 1.00 CTSL (0.51) CTSLCTSBTRPM8ATMCTRB1
SCHEMBL8100330 1.00 CTSL (0.51) CTSLCTSBTRPM8ATMCTRB1
SCHEMBL20825390 0.89 CTSK (0.49) CTSLCTSBTRPM8ATMCTRB1
SCHEMBL1701749 0.87 TRPM8 (0.59) CTSLCTSBTRPM8ATMCTRB1
SCHEMBL17452286 0.87 TRPM8 (0.59) CTSLCTSBTRPM8ATMCTRB1
SCHEMBL1709154 0.87 TRPM8 (0.59) CTSLCTSBTRPM8ATMCTRB1
SCHEMBL12052764 0.87 TRPM8 (0.59) CTSLCTSBTRPM8ATMCTRB1
SCHEMBL1701917 0.87 TRPM8 (0.59) CTSLCTSBTRPM8ATMCTRB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9657058-B2 Compounds for enzyme inhibition ONYX THERAPEUTICS, INC. (US) 2017-05-23 US disclosed
US-20150353601-A1 COMPOUNDS FOR ENZYME INHIBITION ONYX THERAPEUTICS INC (US) 2015-12-10 US disclosed
US-8735441-B2 Compounds for enzyme inhibition ONYX THERAPEUTICS, INC. (US) 2014-05-27 US disclosed
US-8431571-B2 Compounds for enzyme inhibition ONYX THERAPEUTICS, INC. (US) 2013-04-30 US disclosed
US-20130041008-A1 COMPOUNDS FOR ENZYME INHIBITION ONYX THERAPEUTICS, INC. (US) 2013-02-14 US disclosed
US-20130035297-A1 COMPOUNDS FOR ENZYME INHIBITION ONYX THERAPEUTICS, INC. (US) 2013-02-07 US disclosed
US-8357683-B2 Compounds for enzyme inhibition ONYX THERAPEUTICS, INC. (US) 2013-01-22 US disclosed
US-20120088762-A1 COMPOUNDS FOR ENZYME INHIBITION ONYX THERAPEUTICS, INC. (US) 2012-04-12 US disclosed
US-8080576-B2 Compounds for enzyme inhibition ONYX THERAPEUTICS, INC. (US) 2011-12-20 US disclosed
US-8080545-B2 Compounds for enzyme inhibition ONYX THERAPEUTICS, INC. (US) 2011-12-20 US disclosed
US-20100144649-A1 COMPOUNDS FOR ENZYME INHIBITION ONYX THERAPEUTICS, INC. (US) 2010-06-10 US disclosed
US-20100144648-A1 COMPOUNDS FOR ENZYME INHIBITION ONYX THERAPEUTICS, INC. (US) 2010-06-10 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 (6 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-20120088762-A1 COMPOUNDS FOR ENZYME INHIBITION PSME1, PSMB1, PSME3 CTSL 724/4885CTSB 168/4885TRPM8 3475/4885
US-20150353601-A1 COMPOUNDS FOR ENZYME INHIBITION PSME1, PSMB1, PSME3 CTSL 724/4885CTSB 168/4885TRPM8 3475/4885
US-20130041008-A1 COMPOUNDS FOR ENZYME INHIBITION PSME1, PSMB1, PSME3 CTSL 724/4885CTSB 168/4885TRPM8 3475/4885
US-20100144648-A1 COMPOUNDS FOR ENZYME INHIBITION PSME1, PSMB1, PSME3 CTSL 724/4885CTSB 168/4885TRPM8 3475/4885
US-20130035297-A1 COMPOUNDS FOR ENZYME INHIBITION PSME1, PSMB1, PSME3 CTSL 724/4885CTSB 168/4885TRPM8 3475/4885
US-20100144649-A1 COMPOUNDS FOR ENZYME INHIBITION PSME1, PSMB1, PSME3 CTSL 724/4885CTSB 168/4885TRPM8 3475/4885

“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.