SCHEMBL7788653

SCHEMBL7788653

[CH2]CC(O)CCC(O)CCC(O)CC

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.33

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
SCHEMBL7769147 1.00 TSHR (0.33) TSHR
SCHEMBL7514006 0.97 TSHR (0.35) TSHR
SCHEMBL27455701 0.86 TSHR (0.32) TSHR
SCHEMBL30912803 0.85 TSHR (0.44) TSHR
SCHEMBL27473203 0.83 TSHR (0.33) TSHR
SCHEMBL27551277 0.83 FDPS (0.35) TSHR
SCHEMBL31194 0.82
SCHEMBL2589777 0.82
SCHEMBL897485 0.82
SCHEMBL428320 0.82 TSHR (0.47) TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104211620-B The autofrettage of bi-quaternary ammonium salt and its intermediate Wako-chem Industries Co., Ltd. (JP) 2016-05-25 CN disclosed
CN-104211620-A PROCESS FOR PRODUCTION OF BIS-QUATERNARY AMMONIUM SALT, AND NOVEL INTERMEDIATE WAKO PURE CHEM IND LTD 2014-12-17 CN disclosed
CN-1318419-C 1,6,9,14-tetrasubstituted terrylene tetracarboxylic acid diimides BASF AG (DE) 2007-05-30 CN disclosed
CN-1659167-A 1,6,9,14-tetrasubstituted terrylene tetracarboxylic acid diimides BASF AG (DE) 2005-08-24 CN disclosed
EP-0763571-B1 Dye mixtures containing methine and anthraquinone dyes BASF AG (DE) 2001-10-31 EP disclosed
EP-0787169-B1 METHINE AND AZO DYE-CONTAINING DYE MIXTURES BASF AG (DE) 1999-12-22 EP disclosed
US-5853432-A Dye mixtures comprising methine and anthraquinone dyes BASF AKTIENGESELLSCHAFT (DE) 1998-12-29 US disclosed
US-5785719-A Methine and Azo dye-containing dye mixtures BASF AKTIENGESELLSCHAFT (DE) 1998-07-28 US disclosed
EP-0787169-A1 METHINE AND AZO DYE-CONTAINING DYE MIXTURES BASF AKTIENGESELLSCHAFT (DE) 1997-08-06 EP disclosed
EP-0763571-A1 Dye mixtures containing methine and anthraquinone dyes BASF AKTIENGESELLSCHAFT (DE) 1997-03-19 EP disclosed
WO-1996011987-A1 METHINE AND AZO DYE-CONTAINING DYE MIXTURES BASF AKTIENGESELLSCHAFT (DE) 1996-04-25 WO disclosed