SCHEMBL3688912

SCHEMBL3688912

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

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CTSK P43235 13/20 0.50
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA7 P43166 1/20 0.43
CYP2D6 P10635 1/20 0.39
CTSS P25774 4/20 0.37
ATM Q13315 1/20 0.36
CTSL P07711 1/20 0.36
CTSB P07858 1/20 0.36

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
SCHEMBL9906584 1.00 CTSK (0.50) CTSKCA1CA2CA7CYP2D6
SCHEMBL22749258 0.86 CTSK (0.54) CTSKCA1CA2CA7CYP2D6
SCHEMBL806058 0.86 CTSK (0.54) CTSKCA1CA2CA7CYP2D6
SCHEMBL1994082 0.84 CTSK (0.34) CTSK
SCHEMBL19993318 0.83 CTSK (0.49) CTSKCA1CA2CA7CYP2D6
SCHEMBL13365447 0.78 CTSK (0.54) CTSKCA1CA2CA7CYP2D6
SCHEMBL4388619 0.76 CTSK (0.43) CTSKCA1CA2CA7CYP2D6
SCHEMBL18553069 0.76 CTSK (0.53) CTSKCA1CA2CA7CYP2D6
SCHEMBL2058674 0.76 CTSK (0.53) CTSKCA1CA2CA7CYP2D6
SCHEMBL963465 0.76 CTSK (0.53) CTSKCA1CA2CA7CYP2D6

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-8198364-B2 Poly (vinyl alcohol) polymers, uses and preparation thereof VALORISATION-RECHERCHE, LIMITED PARTNERSHIP (CA) 2012-06-12 US disclosed
US-20100038297-A1 Poly (Vinyl Alcohol) Polymers, Uses and Preparation Thereof UNIVERSITE DE MONTREAL (CA) 2010-02-18 US disclosed
EP-2029644-A1 POLY (VINYL ALCOHOL) POLYMERS, USES AND PREPARATION THEREOF Valorisation-Recherche, Société en Commandite (CA) 2009-03-04 EP disclosed
WO-2007143848-A1 POLY (VINYL ALCOHOL) POLYMERS, USES AND PREPARATION THEREOF Valorisation-Recherche, Société en Commandite (CA) 2007-12-21 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-20100038297-A1 Poly (Vinyl Alcohol) Polymers, Uses and Preparation Thereof PUF60, VCL, PARG CTSK 4392/4885CA1 3289/4885CA2 4757/4885

“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.