SCHEMBL3277532

SCHEMBL3277532

NC(C[C](S)S)C(=O)O

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL24709409 0.83 — —
SCHEMBL10618897 0.78 PTGS1 (0.55) —
SCHEMBL12294860 0.78 — —
SCHEMBL6832737 0.78 PTGS1 (0.55) —
Aspartic Acid SCHEMBL7706079 0.78 PTGS1 (0.55) —
Aspartic Acid SCHEMBL1526976 0.77 GRIK1 (0.56) —
Aspartic Acid SCHEMBL11065189 0.77 GRIK1 (0.56) —
Aspartic Acid SCHEMBL3230 0.77 — —
Aspartic Acid SCHEMBL11065185 0.77 GRIK1 (0.56) —
Aspartic Acid SCHEMBL3231 0.77 — —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100056575-A1 Anesthetic Compounds SIGNATURE THERAPEUTICS, INC. 2010-03-04 — — US claimed
US-7018989-B2 Chemical compounds UNIVERSITY COLLEGE CARDIFF CONSULTANTS, LTD (GB) 2006-03-28 — — US claimed
US-6455513-B1 ARYL SUBSTITUTED PHOSPHORYL DERIVATIVES; VIRICIDES AGAINST HUMAN T-CELL LEUKEMIA/LYMPHOMA VIRUSES UNIVERSITY COLLEGE CARDIFF CONSULTANTS LTD. (GB) 2002-09-24 — — US claimed
US-5326867-A Antibiotics BRISTOL-MYERS SQUIBB COMPANY (US) 1994-07-05 — — US claimed
EP-0580480-A1 Pradimic acids, amides, and novel pradimicin derivatives Bristol-Myers Squibb Company (US) 1994-01-26 — — EP claimed
US-7700087-B2 Compounds and methods to inhibit or augment an inflammatory response CAMBRIDGE ENTERPRISE LIMITED (GB) 2010-04-20 — — US disclosed
US-20100056575-A1 Anesthetic Compounds SIGNATURE THERAPEUTICS, INC. 2010-03-04 — — US disclosed
EP-1012187-B1 CHEMOKINE PEPTIDES, VARIANTS, DERIVATIVES AND ANALOGS. THEIR USE IN METHODS TO INHIBIT OR AUGMENT AN INFLAMMATORY RESPONSE CAMBRIDGE ENTPR LTD (GB) 2009-08-26 — — EP disclosed
EP-2069299-A2 ANESTHETIC COMPOUNDS Pharmacofore, Inc. (US) 2009-06-17 — — EP disclosed
WO-2008011539-A2 ANESTHETIC COMPOUNDS PHARMACOFORE, INC. (US) 2008-01-24 — — WO disclosed
US-7067117-B1 Compounds and methods to inhibit or augment an inflammatory response CAMBRIDGE UNIVERSITY TECHNICAL SERVICES, LTD. (GB) 2006-06-27 — — US disclosed
US-20060073114-A1 Compounds and methods to inhibit or augment an inflammatory response CAMBRIDGE UNIVERSITY TECHNICAL SERVICES LTD. 2006-04-06 — — US disclosed
US-6455513-B1 ARYL SUBSTITUTED PHOSPHORYL DERIVATIVES; VIRICIDES AGAINST HUMAN T-CELL LEUKEMIA/LYMPHOMA VIRUSES UNIVERSITY COLLEGE CARDIFF CONSULTANTS LTD. (GB) 2002-09-24 — — US disclosed
EP-1012187-A2 CHEMOKINE PEPTIDES, VARIANTS, DERIVATIVES AND ANALOGS. THEIR USE IN METHODS TO INHIBIT OR AUGMENT AN INFLAMMATORY RESPONSE NEORX CORPORATION (US) 2000-06-28 — — EP disclosed
WO-1999012968-A2 CHEMOKINE PEPTIDES, VARIANTS, DERIVATIVES AND ANALOGS, THEIR USE IN METHODS TO INHIBIT OR AUGMENT AN INFLAMMATORY RESPONSE NEORX CORPORATION (US) 1999-03-18 — — WO disclosed
US-5608044-A ANTIBIOTIC INTERMEDIATES BRISTOL-MYERS SQUIBB COMPANY (US) 1997-03-04 — — US disclosed
US-5414073-A Treatment with dimethylphosphoryl azide and hydrolysis BRISTOL-MYERS SQUIBB (US) 1995-05-09 — — US disclosed
US-5326867-A Antibiotics BRISTOL-MYERS SQUIBB COMPANY (US) 1994-07-05 — — US disclosed
EP-0580480-A1 Pradimic acids, amides, and novel pradimicin derivatives Bristol-Myers Squibb Company (US) 1994-01-26 — — EP disclosed
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