SCHEMBL12852243

SCHEMBL12852243

CNC(=O)[C@H](N)CS

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
SCHEMBL4297372 1.00
SCHEMBL12519877 1.00
SCHEMBL21134724 0.82 BMP1 (0.43)
SCHEMBL21134870 0.82 BMP1 (0.43)
SCHEMBL11111414 0.81
SCHEMBL10786566 0.81
SCHEMBL1632802 0.80
SCHEMBL8352097 0.79 PTGS1 (0.55)
SCHEMBL21510761 0.79 MMP2 (0.41)
SCHEMBL12534363 0.78 DPP7 (0.43)

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
EP-3508476-B1 AMINO MERCAPTAN COMPOUND AND PREPARATION METHOD THEREFOR AND USE THEREOF IN PROTECTION AGAINST RADIATION SHANGHAI KECHOW PHARMA INC (CN) 2023-11-22 EP disclosed
US-9814787-B2 Luciferin amides UNIVERSITY OF MASSACHUSETTS (US) 2017-11-14 US disclosed
US-9814787-B2 Luciferin amides UNIVERSITY OF MASSACHUSETTS (US) 2017-11-14 US disclosed
US-9814787-B2 Luciferin amides UNIVERSITY OF MASSACHUSETTS (US) 2017-11-14 US disclosed
US-20160279268-A1 Luciferin Amides UNIVERSITY OF MASSACHUSETTS 2016-09-29 US disclosed
US-20160279268-A1 Luciferin Amides UNIVERSITY OF MASSACHUSETTS 2016-09-29 US disclosed
US-20160279268-A1 Luciferin Amides UNIVERSITY OF MASSACHUSETTS 2016-09-29 US disclosed
US-9370588-B2 Luciferin amides UNIVERSITY OF MASSACHUSETTS (US) 2016-06-21 US disclosed
US-9370588-B2 Luciferin amides UNIVERSITY OF MASSACHUSETTS (US) 2016-06-21 US disclosed
US-9370588-B2 Luciferin amides UNIVERSITY OF MASSACHUSETTS (US) 2016-06-21 US disclosed
US-20140193340-A1 Luciferin Amides UNIVERSITY OF MASSACHUSETTS (US) 2014-07-10 US disclosed
US-20140193340-A1 Luciferin Amides UNIVERSITY OF MASSACHUSETTS (US) 2014-07-10 US disclosed
US-20140193340-A1 Luciferin Amides UNIVERSITY OF MASSACHUSETTS (US) 2014-07-10 US disclosed
US-8288351-B2 Antagonists of the bradykinin B1 receptor AMGEN INC. (US) 2012-10-16 US disclosed
US-8278280-B2 Antagonists of the bradykinin B1 receptor AMGEN INC. (US) 2012-10-02 US disclosed
US-7605120-B2 peptides and/or conjugated peptides may be used as therapeutics or prophylactics for the treatment of diseases mediated by B1 activation, including inflammation and chronic pain states of inflammatory and neuropathic origin, septic shock, arthritis, osteoarthritis, angina, asthma, allergic rhinitis AMGEN INC. (US) 2009-10-20 US disclosed
US-20090137452-A1 Antagonists of the bradykinin B1 receptor AMGEN INC. 2009-05-28 US disclosed
US-20090137483-A1 Antagonists of the bradykinin B1 receptor AMGEN INC. 2009-05-28 US disclosed
US-20090048149-A1 Antagonists of the bradykinin B1 receptor AMGEN INC. 2009-02-19 US disclosed