SCHEMBL166206

SCHEMBL166206

CCC[CH]NC(=O)OC(C)(C)C

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.42
CA7 P43166 2/20 0.42
CA12 O43570 2/20 0.42
CA14 Q9ULX7 2/20 0.42
TDP1 Q9NUW8 1/20 0.38
CTSK P43235 9/20 0.37
CA2 P00918 2/20 0.37
KMT2A Q03164 2/20 0.36
ALDH1A1 P00352 1/20 0.36
CTSS P25774 1/20 0.36
MEN1 O00255 1/20 0.36
GAA P10253 1/20 0.36
MAPK10 P53779 1/20 0.36
APLNR P35414 1/20 0.35

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
SCHEMBL6611508 0.89 CTSK (0.41) CA1CA7CA12CA14TDP1
SCHEMBL10744068 0.87 CTSK (0.40) CA1CA7CA12CA14TDP1
SCHEMBL15824368 0.85 TDP1 (0.41) CA1CA7CA12CA14TDP1
SCHEMBL16929983 0.85 TDP1 (0.41) CA1CA7CA12CA14TDP1
SCHEMBL166623 0.85 CA1 (0.42) CA1CA7CA12CA14TDP1
SCHEMBL6610938 0.81 CTSK (0.38) CA1CA7CA12CA14TDP1
SCHEMBL10776406 0.81 CA1 (0.40) CA1CA7CA12CA14TDP1
SCHEMBL10100401 0.81 CA1 (0.40) CA1CA7CA12CA14TDP1
SCHEMBL6610088 0.81 CTSK (0.38) CA1CA7CA12CA14TDP1
SCHEMBL7881938 0.79 MAOA (0.41) CA1CA7CA12CA14TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210130315-A1 METHOD FOR THE SYNTHESIS OF CYCLIC DEPSIPEPTIDES BAYER ANIMAL HEALTH GMBH (DE) 2021-05-06 US claimed
CN-111757880-A Method for synthesizing cyclic depsipeptides 拜耳动物保健有限责任公司 2020-10-09 CN claimed
EP-3676265-A1 METHOD FOR THE SYNTHESIS OF CYCLIC DEPSIPEPTIDES Bayer Animal Health GmbH (DE) 2020-07-08 EP claimed
EP-3480195-A1 METHOD FOR THE SYNTHESIS OF CYCLIC DEPSIPEPTIDES Bayer Animal Health GmbH (DE) 2019-05-08 EP claimed
US-7834007-B2 CGRP antagonists BRISTOL-MYERS SQUIBB COMPANY (US) 2010-11-16 US claimed
US-20070049577-A1 CGRP antagonists BRISTOL-MYERS SQUIBB COMPANY 2007-03-01 US claimed
US-5856324-A Use of dioxomorpholines for combat endoparasites, dioxomorpholines and process for their production BAYER AKTIENGESELLSCHAFT (DE) 1999-01-05 US claimed
US-5571793-A COMBATTING ENDOPARASITES IN HUMANS OR ANIMALS BY ADMINISTERING PEPTIDES BAYER AKTIENGESELLSCHAFT (DE) 1996-11-05 US claimed
EP-3383378-B1 METHODS FOR INHIBITING CONVERSION OF CHOLINE TO TRIMETHYLAMINE (TMA) PROCTER & GAMBLE (US) 2024-04-17 EP disclosed
US-11780841-B2 3,6-methano-1H-pyrrolo[3,2-b]pyridine and 3,6-methano-1H-pyrrolo[3,2-c]pyridine compounds and medicaments using same IRIMAJIRI THERAPEUTICS INC. (JP) 2023-10-10 US disclosed
CN-116348147-A Compositions for delivery of payload molecules to airway epithelium 摩登纳特斯有限公司 2023-06-27 CN disclosed
EP-4104902-A1 COMPOUND AND DRUG CONTAINING SAME Oita University Institute of Advanced Medicine, Inc. (JP) 2022-12-21 EP disclosed
US-20220194942-A1 3,6-METHANO-1H-PYRROLO[3,2-b]PYRIDINE AND 3,6-METHANO-1H-PYRROLO[3,2-c]PYRIDINE COMPOUNDS AND MEDICAMENTS USING SAME IRIMAJIRI THERAPEUTICS INC. (JP) 2022-06-23 US disclosed
US-20210214356-A1 COMPOUNDS AND MEDICAMENTS USING SAME IRIMAJIRI THERAPEUTICS INC. (JP) 2021-07-15 US disclosed
EP-0662326-A2 Endoparasitical agents containing praziquantel and epsiprantel BAYER AG (DE) 1995-07-12 EP disclosed
EP-0657172-A1 Endoparasiticide drugs on a basis of open chain tetradepsipeptides BAYER AG (DE) 1995-06-14 EP disclosed
EP-0657173-A1 Endoparasiticide drugs on a basis of open chain hexadepsipeptides BAYER AG (DE) 1995-06-14 EP disclosed
EP-0657171-A1 Endoparasiticide drugs on a basis of open chain octadepsipeptides BAYER AG (DE) 1995-06-14 EP disclosed
EP-0423943-A2 Use of collagenase inhibitors in the treatment of demyelinating diseases, in particular multiple sclerosis Beecham Group p.l.c. (GB) 1991-04-24 EP disclosed
US-4698337-A Cephem compounds and processes for preparation thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1987-10-06 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-20210130315-A1 METHOD FOR THE SYNTHESIS OF CYCLIC DEPSIPEPTIDES DNPEP, NPEPPS, PREP CA1 2176/4885CA7 846/4885CA12 565/4885
US-11780841-B2 3,6-methano-1H-pyrrolo[3,2-b]pyridine and 3,6-methano-1H-pyrrolo[3,2-c]pyridine compounds and medicaments using same AVPR1B, AVPR2, F12 CA1 773/4885CA7 906/4885CA12 661/4885
US-20070049577-A1 CGRP antagonists CALCRL, CALCR, CALCA CA1 2299/4885CA7 2237/4885CA12 2597/4885
US-20210214356-A1 COMPOUNDS AND MEDICAMENTS USING SAME F12, GDI2, RDX CA1 164/4885CA7 184/4885CA12 87/4885
US-20220194942-A1 3,6-METHANO-1H-PYRROLO[3,2-b]PYRIDINE AND 3,6-METHANO-1H-PYRROLO[3,2-c]PYRIDINE COMPOUNDS AND MEDICAMENTS USING SAME AVPR1B, AVPR2, F12 CA1 773/4885CA7 906/4885CA12 661/4885

“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.