SCHEMBL3333284

SCHEMBL3333284

COC(OC)C(CC(C)C)NC(=O)OCc1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CTSK P43235 11/20 0.60
CTSS P25774 3/20 0.56
CTSL P07711 3/20 0.56
CTSB P07858 2/20 0.56
TRPM8 Q7Z2W7 1/20 0.54
ATM Q13315 1/20 0.52
MEN1 O00255 1/20 0.51
LMNA P02545 1/20 0.51
KMT2A Q03164 1/20 0.51
ACE2 Q9BYF1 1/20 0.51
CAPN1 P07384 1/20 0.51

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
SCHEMBL8972715 0.90 CTSK (0.69) CTSKCTSSCTSLCTSBCAPN1
SCHEMBL14011286 0.87 CTSK (0.64) CTSKCTSSCTSLCTSBTRPM8
SCHEMBL3331611 0.86 TRPM8 (0.67) CTSKCTSSCTSLCTSBTRPM8
SCHEMBL8353955 0.86 CTSK (0.62) CTSKCTSSCTSLCTSBTRPM8
SCHEMBL24722341 0.85 REN (0.60) CTSKCTSB
SCHEMBL10062613 0.85 CTSK (0.58) CTSKCTSSCTSLCTSBTRPM8
SCHEMBL25222634 0.85 TRPM8 (0.55) CTSKTRPM8ATM
SCHEMBL25271394 0.85 TRPM8 (0.55) CTSKTRPM8ATM
SCHEMBL25224988 0.85 TRPM8 (0.55) CTSKTRPM8ATM
SCHEMBL10100520 0.85 CTSK (0.61) CTSKCTSSCTSLCTSBTRPM8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2137139-B1 PROCESS OF DEACETALISATION OF ALPHA AMINOACETALS CLARIANT SPECIALTY FINE CHEM (FR) 2014-09-10 EP disclosed
CN-101679223-B Deacetalization of alpha aminoacetals CLARIANT SPECIALTY FINE CHEM 2014-04-16 CN disclosed
US-8609882-B2 Process for deacetalisation of α aminoacetals CLARIANT SPECIALITY FINE CHEMICALS (FRANCE) (FR) 2013-12-17 US disclosed
US-20100137633-A1 Process For Deacetalisation Of Alpha Aminoacetals CLARIANT SPECIALTY FINE CHEMICALS (FRANCE) (FR) 2010-06-03 US disclosed
CN-101679223-A Deacetalization of alpha aminoacetals CLARIANT SPECIALTY FINE CHEM 2010-03-24 CN disclosed
EP-2137139-A1 PROCESS OF DEACETALISATION OF ALPHA AMINOACETALS Clariant Specialty Fine Chemicals (France) (FR) 2009-12-30 EP disclosed
WO-2008125486-A1 PROCESS OF DEACETALISATION OF ALPHA AMINOACETALS CLARIANT SPECIALTY FINE CHEMICALS (FRANCE) (FR) 2008-10-23 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-20100137633-A1 Process For Deacetalisation Of Alpha Aminoacetals ALDH7A1, AADAT, AASDHPPT CTSK 1982/4885CTSS 1339/4885CTSL 1941/4885

“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.