SCHEMBL2936713

SCHEMBL2936713

CC(SC(C)C(=O)[O-])C(=O)[O-].CC(SC(C)C(=O)[O-])C(=O)[O-].CC(SC(C)C(=O)[O-])C(=O)[O-].CCCCCCCC[Sn+3].CCCCCCCC[Sn+3]

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.46
EPHX1 P07099 1/20 0.44
CA2 P00918 2/20 0.43
CES2 O00748 4/20 0.39
CES1 P23141 4/20 0.39
GPR84 Q9NQS5 1/20 0.36
LMNA P02545 2/20 0.35
MEN1 O00255 1/20 0.35
FAAH O00519 1/20 0.35
MAPK1 P28482 1/20 0.35
KMT2A Q03164 1/20 0.35
FABP3 P05413 2/20 0.34

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
SCHEMBL4196107 0.84 CA1 (0.52) CA1EPHX1CA2CES2CES1
L-Lactic Acid SCHEMBL6072494 0.82 CA1 (0.50) CA1EPHX1CA2CES2CES1
SCHEMBL3269704 0.81 CA1 (0.48) CA1EPHX1CA2CES2CES1
SCHEMBL6072645 0.78 CA1 (0.66) CA1CA2CES2CES1GPR84
SCHEMBL6072346 0.78 CA1 (0.78) CA1CA2GPR84
SCHEMBL6073025 0.78 CA1 (0.78) CA1CA2GPR84
Acetic Acid SCHEMBL2573452 0.78 CES2 (0.50) CA1CA2CES2CES1GPR84
Acetic Acid SCHEMBL10615890 0.78 CES2 (0.50) CA1CA2CES2CES1GPR84
Acetic Acid SCHEMBL2572937 0.78 CES2 (0.50) CA1CA2CES2CES1GPR84
Acetic Acid SCHEMBL27659112 0.78 CES2 (0.50) CA1CA2CES2CES1GPR84

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5688890-A Thermoplastic polyurethane composition KURARAY CO., LTD. (JP) 1997-11-18 US claimed
EP-3960450-A1 THERMOPLASTIC POLYURETHANE RESIN ELASTOMER Mitsubishi Chemical Corporation (JP) 2022-03-02 EP disclosed
CN-113727855-A Thermoplastic polyurethane resin elastomer 三菱化学株式会社 2021-11-30 CN disclosed
CN-113727854-A Thermoplastic polyurethane resin elastomer 三菱化学株式会社 2021-11-30 CN disclosed
EP-2881412-B1 THERMOPLASTIC POLYURETHANE AND A COMPOSITION THEREOF KURARAY CO (JP) 2019-06-26 EP disclosed
US-9593200-B2 Thermoplastic polyurethane and a composition thereof KURARAY CO., LTD. (JP) 2017-03-14 US disclosed
EP-2492296-B1 Resin composition for laser engraving, relief printing plate precursor and process for producing the same, and relief printing plate FUJIFILM CORP (JP) 2015-12-16 EP disclosed
US-20150210799-A1 THERMOPLASTIC POLYURETHANE AND A COMPOSITION THEREOF KURARAY CO., LTD. (JP) 2015-07-30 US disclosed
EP-2881412-A1 THERMOPLASTIC POLYURETHANE AND A COMPOSITION THEREOF Kuraray Co., Ltd. (JP) 2015-06-10 EP disclosed
EP-2492296-A2 Resin composition for laser engraving, relief printing plate precursor and process for producing the same, and relief printing plate Fujifilm Corporation (JP) 2012-08-29 EP disclosed
EP-1411086-B1 THERMOPLASTIC POLYMER COMPOSITION KURARAY CO (JP) 2010-09-15 EP disclosed
US-7138447-B2 Thermoplastic polymer composition KURARAY CO., LTD. (JP) 2006-11-21 US disclosed
US-20040176525-A1 Thermoplastic polymer composition KURARAY CO., LTD. (JP) 2004-09-09 US disclosed
EP-1411086-A1 THERMOPLASTIC POLYMER COMPOSITION Kuraray Co., Ltd. (JP) 2004-04-21 EP disclosed
EP-0651017-B1 THERMOPLASTIC POLYURETHANE COMPOSITION KURARAY CO (JP) 1999-10-27 EP disclosed
US-5912193-A RESILIENT POLYESTERURETHANE COPOLYMERS FORMED INTO FIBERS BY MELT SPINNING KURARAY CO., LTD. (JP) 1999-06-15 US disclosed
US-5780573-A MADE WITH ORGANIC DIISOCYANATE, CHAIN EXTENDER AND POLYESTER-POLYOL THAT SATISIFIES SPECIFIED REQUIREMENTS KURARAY CO., LTD. (JP) 1998-07-14 US disclosed
US-5688890-A Thermoplastic polyurethane composition KURARAY CO., LTD. (JP) 1997-11-18 US disclosed
EP-0748829-A1 Thermoplastic polyurethanes and molded articles comprising them KURARAY CO., LTD. (JP) 1996-12-18 EP disclosed
EP-0651017-A1 THERMOPLASTIC POLYURETHANE COMPOSITION KURARAY CO., LTD. (JP) 1995-05-03 EP disclosed