SCHEMBL318796

SCHEMBL318796

CCC(NC(=O)OC(C)(C)C)C(=O)O

nearest known ligand 0.64

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CTSK P43235 8/20 0.64
CTSS P25774 7/20 0.64
PPARA Q07869 6/20 0.49
PPARG P37231 5/20 0.49
CTSL P07711 1/20 0.49
CTSB P07858 1/20 0.49
ACE P12821 1/20 0.48
CYP1A2 P05177 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
HTT P42858 1/20 0.48
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
CA7 P43166 1/20 0.47
PPARD Q03181 2/20 0.47
MEN1 O00255 1/20 0.46
GAA P10253 1/20 0.46
KMT2A Q03164 1/20 0.46
CAPN1 P07384 1/20 0.46

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
SCHEMBL835996 1.00 CTSK (0.64) CTSKCTSSPPARAPPARGCTSL
SCHEMBL1951491 1.00 CTSK (0.64) CTSKCTSSPPARAPPARGCTSL
SCHEMBL31407722 0.90 CTSK (0.54) CTSKCTSSPPARAPPARGCTSL
SCHEMBL31230470 0.90 CTSK (0.54) CTSKCTSSPPARAPPARGCTSL
SCHEMBL28201406 0.89 CTSK (0.54) CTSKCTSSPPARAPPARGCTSL
SCHEMBL28201407 0.89 CTSK (0.54) CTSKCTSSPPARAPPARGCTSL
Tetrahydrofuran SCHEMBL28201868 0.87 CTSK (0.52) CTSKCTSSPPARAPPARGCTSL
Tetrahydrofuran SCHEMBL28201869 0.87 CTSK (0.52) CTSKCTSSPPARAPPARGCTSL
SCHEMBL13367322 0.86 CTSK (0.63) CTSKCTSSCTSLCTSBCA1
SCHEMBL15695733 0.86 CTSK (0.54) CTSKCTSSPPARAPPARGCTSL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108794572-B Total synthesis method of natural product Lucentamycin A 上海交通大学 2021-10-15 CN claimed
US-20190144452-A1 PROCESS FOR PREPARING IDELALISIB SYNTHON B.V. (NL) 2019-05-16 US claimed
CN-106854183-B The preparation method of Ai Dailalisi intermediate 山东轩德医药科技有限公司 2018-11-16 CN claimed
CN-108794572-A A kind of natural products Lucentamycin A total synthesis methods 上海交通大学 2018-11-13 CN claimed
CN-106854183-A The preparation method of Ai Dailalisi intermediates 山东轩德医药科技有限公司 2017-06-16 CN claimed
CN-106146352-A Idelalisib intermediate and preparation method thereof 上海医药工业研究院 2016-11-23 CN claimed
CN-104262201-A Synthesis method of chiral optically-pure (S)-3-aminovaleric acid UNIV JIANGXI NORMAL SCI & TECH 2015-01-07 CN claimed
CN-104086459-A Novel method for chiral synthesis of optical pure (S)-3-aminopentanoic acid UNIV JIANGXI NORMAL SCI & TECH 2014-10-08 CN claimed
US-20260125378-A2 Heterocyclic Compounds BEONE MEDICINES I GMBH (CH) 2026-05-07 US disclosed
EP-4731309-A1 KRAS PROTEOLYSIS TARGETING CHIMERAS Paq Therapeutics Inc. (US) 2026-04-29 EP disclosed
US-20260083708-A1 IL-17 MODULATORS AND USES THEREOF NNOCARE PHARMA INC (US) 2026-03-26 US disclosed
EP-4713321-A1 PROTACS FOR ASK1 PROTEIN DEGRADATION: PREPARATION AND USE THEREOF Council of Scientific and Industrial Research (IN) 2026-03-25 EP disclosed
US-20260069602-A1 COMPOUNDS, COMPOSITIONS, AND METHODS ACONCAGUA BIO INC (US) 2026-03-12 US disclosed
US-12552823-B2 Glucosamine derivatives and pharmaceutical uses thereof Risen (Suzhou) Pharma Tech Co., Ltd. (CN) 2026-02-17 US disclosed
EP-0189305-A2 Peptide derivatives ICI AMERICAS INC. (US) 1986-07-30 EP disclosed
EP-0133795-A1 Gaba esters and gaba analogue esters THE McLEAN HOSPITAL CORPORATION (US) 1985-03-06 EP disclosed
WO-1985000520-A1 GABA ESTERS AND GABA ANALOGUE ESTERS THE MCLEAN HOSPITAL CORPORATION (US) 1985-02-14 WO disclosed
EP-0105193-A2 Spergualin-related compounds, processes for the preparation thereof and their use as medicaments MICROBIAL CHEMISTRY RESEARCH FOUNDATION (JP) 1984-04-11 EP disclosed
US-4005194-A NONAPEPTIDE ABBOTT LABORATORIES (US) 1977-01-25 US disclosed
US-4002738-A Treatment of specified neoplasias ABBOTT LABORATORIES (US) 1977-01-11 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 (5 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-20260125378-A2 Heterocyclic Compounds NFATC1, CD4, MALT1 CTSK 2817/4885CTSS 1575/4885PPARA 3072/4885
US-20260083708-A1 IL-17 MODULATORS AND USES THEREOF IL17A, IL2, IL23R CTSK 2954/4885CTSS 2855/4885PPARA 1008/4885
US-12552823-B2 Glucosamine derivatives and pharmaceutical uses thereof SOST, FUT6, SLC5A1 CTSK 874/4885CTSS 1006/4885PPARA 554/4885
US-20190144452-A1 PROCESS FOR PREPARING IDELALISIB IDE, ALK, PIK3C3 CTSK 2110/4885CTSS 2356/4885PPARA 1747/4885
US-20260069602-A1 COMPOUNDS, COMPOSITIONS, AND METHODS SCTR, SSTR1, NPY1R CTSK 1920/4885CTSS 1117/4885PPARA 1773/4885

“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.