SCHEMBL212772

SCHEMBL212772

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

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CTSK P43235 8/20 0.47
CTSS P25774 6/20 0.47
SMN1; SMN2 Q16637 1/20 0.46
PPARA Q07869 6/20 0.45
PPARG P37231 5/20 0.45
CTSL P07711 1/20 0.44
CTSB P07858 1/20 0.44
ACE P12821 1/20 0.44
PPARD Q03181 2/20 0.43
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA7 P43166 1/20 0.42
MAPT P10636 1/20 0.42
IDO1 P14902 1/20 0.41

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
SCHEMBL2728681 1.00 CTSK (0.47) CTSKCTSSSMN1; SMN2PPARAPPARG
SCHEMBL212773 1.00 CTSK (0.47) CTSKCTSSSMN1; SMN2PPARAPPARG
SCHEMBL21904767 0.87 CTSK (0.44) CTSKCTSSSMN1; SMN2CTSLCTSB
SCHEMBL15083313 0.87 SMN1; SMN2 (0.49) CTSKCTSSSMN1; SMN2CTSLCTSB
SCHEMBL4038634 0.87 SMN1; SMN2 (0.46) CTSKCTSSSMN1; SMN2CTSLCTSB
SCHEMBL16289367 0.87 SMN1; SMN2 (0.49) CTSKCTSSSMN1; SMN2CTSLCTSB
SCHEMBL4038638 0.87 SMN1; SMN2 (0.46) CTSKCTSSSMN1; SMN2CTSLCTSB
SCHEMBL2179710 0.86 GRIK1 (0.44) CTSKCTSSSMN1; SMN2PPARAPPARG
SCHEMBL29273137 0.86 GRIK1 (0.44) CTSKCTSSSMN1; SMN2PPARAPPARG
SCHEMBL13571099 0.86 GRIK1 (0.44) CTSKCTSSSMN1; SMN2PPARAPPARG

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 379 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1300395-B1 4-SUBSTITUTED PIPERIDINE COMPOUND EISAI R&D MAN CO LTD (JP) 2009-09-02 EP claimed
US-20050026895-A1 4-Substituted piperidine compound EISAI CO., LTD. 2005-02-03 US claimed
US-20030166925-A1 4-Substituted piperidine compound EISAI R&D MANAGEMENT CO., LTD. (JP) 2003-09-04 US claimed
EP-1300395-A1 4-SUBSTITUTED PIPERIDINE COMPOUND Eisai Co., Ltd. (JP) 2003-04-09 EP claimed
EP-3829559-B1 INHIBITORS OF HISTONE DEACETYLASE USEFUL FOR THE TREATMENT OR PREVENTION OF HIV INFECTION MERCK SHARP & DOHME LLC (US) 2026-05-13 EP disclosed
EP-4720058-A2 BIFUNCTIONAL DEGRADERS AND USES THEREOF Casma Therapeutics, Inc. (US) 2026-04-08 EP disclosed
EP-4712969-A1 CYCLIN INHIBITORS Circle Pharma, Inc. (US) 2026-03-25 EP disclosed
US-20260015373-A1 STAT6 MODULATORS AND USES THEREOF RECLUDIX PHARMA INC (US) 2026-01-15 US disclosed
EP-3604326-B1 PEPTIDE COMPOUND AND METHOD FOR PRODUCING SAME, COMPOSITION FOR SCREENING USE, AND METHOD FOR SELECTING PEPTIDE COMPOUND FUJIFILM CORP (JP) 2026-01-07 EP disclosed
US-12473331-B2 Macrocyclic compounds as proteasome inhibitors CORNELL UNIVERSITY (US) 2025-11-18 US disclosed
US-12415835-B2 Peptide-compound cyclization method CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2025-09-16 US disclosed
US-12404274-B2 Macrocycles as factor xia inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2025-09-02 US disclosed
EP-1261610-A2 SUCCINOYLAMINO CARBOCYCLES AND HETEROCYCLES AS INHIBITORS OF A-BETA PROTEIN PRODUCTION Bristol-Myers Squibb Pharma Company (US) 2002-12-04 EP disclosed
US-20020156018-A1 Treatment of parasitic diseases by inhibition of cysteine proteases of the papain superfamily THOMPSON SCOTT KEVIN (US) 2002-10-24 US disclosed
US-6423869-B1 BACTERICIDES, ANTIULCER AGENTS TAKEDA CHEMICAL INDUSTRIES, INC. (JP) 2002-07-23 US disclosed
US-20020055501-A1 Succinoylamino carbocycles and heterocycles as inhibitors of a-beta protein production BRISTOL-MYERS SQUIBB PHARMA COMPANY 2002-05-09 US disclosed
EP-1149843-A1 SUBSTITUTED PHENETHYLAMINE DERIVATIVES CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2001-10-31 EP disclosed
WO-2001060826-A2 SUCCINOYLAMINO CARBOCYCLES AND HETEROCYCLES AS INHIBITORS OF Aβ PROTEIN PRODUCTION BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2001-08-23 WO disclosed
CN-1304447-A Treatment of parasitic diseases by inhibition of cysteine proteases of papain superfamily SMITHKLINE BEECHAM CORP (US) 2001-07-18 CN disclosed
US-5508466-A REACTING MIXTURE OF N-PROTECTED-ALPHA-SUBSTITUTED-GLYCINE CATION DERIVATIVE AND ELEMENTAL ZINC WITH ORGANIC HALIDE IN POLAR SOLVENT G.D. SEARLE & CO. (US) 1996-04-16 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 (8 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-12404274-B2 Macrocycles as factor xia inhibitors TFPI, TFPI2, F11 CTSK 85/4885CTSS 213/4885SMN1; SMN2 3689/4885
US-20050026895-A1 4-Substituted piperidine compound ACHE, CHRM2, CHRM1 CTSK 1517/4885CTSS 1315/4885SMN1; SMN2 1984/4885
US-20260015373-A1 STAT6 MODULATORS AND USES THEREOF STAT6, STAT5A, STAT3 CTSK 2775/4885CTSS 3327/4885SMN1; SMN2 4276/4885
US-12473331-B2 Macrocyclic compounds as proteasome inhibitors PSMB5, PSMB1, PSMB3 CTSK 1101/4885CTSS 640/4885SMN1; SMN2 271/4885
US-20030166925-A1 4-Substituted piperidine compound ACHE, CHRM4, CHRM1 CTSK 1336/4885CTSS 1370/4885SMN1; SMN2 1815/4885
US-20020156018-A1 Treatment of parasitic diseases by inhibition of cysteine proteases of the papain superfamily PEPD, PREP, CPN1 CTSK 64/4885CTSS 4/4885SMN1; SMN2 4763/4885
US-20020055501-A1 Succinoylamino carbocycles and heterocycles as inhibitors of a-beta protein production APP, APH1A, APH1B CTSK 1372/4885CTSS 332/4885SMN1; SMN2 382/4885
US-12415835-B2 Peptide-compound cyclization method VIP, NGLY1, GLP1R CTSK 188/4885CTSS 273/4885SMN1; SMN2 4620/4885

“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.