SCHEMBL2016896

SCHEMBL2016896

O=C(O)C=CC(=O)Nc1ccc(S(=O)(=O)O)cc1

nearest known ligand 0.67

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 11/20 0.67
▸ THRB P10828 2/20 0.67
▸ LPAR2 Q9HBW0 2/20 0.66
▸ LPAR3 Q9UBY5 1/20 0.66
▸ MAPT P10636 4/20 0.64
▸ L3MBTL1 Q9Y468 2/20 0.64
▸ TDP2 O95551 1/20 0.64
▸ GAA P10253 1/20 0.64
▸ POLB P06746 2/20 0.62
▸ NMT1 P30419 1/20 0.62
▸ KDM4E B2RXH2 1/20 0.60
▸ SMN1; SMN2 Q16637 1/20 0.60
▸ HPGD P15428 1/20 0.58
▸ LMNA P02545 1/20 0.57
▸ NR4A1 P22736 1/20 0.57
▸ MEN1 O00255 1/20 0.57
▸ KMT2A Q03164 1/20 0.57
▸ LPAR1 Q92633 1/20 0.54

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
SCHEMBL2016892 1.00 ALDH1A1 (0.67) ALDH1A1THRBLPAR2LPAR3MAPT
SCHEMBL8673997 1.00 ALDH1A1 (0.67) ALDH1A1THRBLPAR2LPAR3MAPT
SCHEMBL15078372 0.88 ALDH1A1 (0.68) ALDH1A1THRBLPAR2LPAR3MAPT
SCHEMBL22663672 0.88 ALDH1A1 (0.68) ALDH1A1THRBLPAR2LPAR3MAPT
SCHEMBL11137034 0.85 LPAR2 (0.88) ALDH1A1THRBLPAR2LPAR3MAPT
SCHEMBL11133691 0.85 LPAR2 (0.88) ALDH1A1THRBLPAR2LPAR3MAPT
SCHEMBL97458 0.85 ALDH1A1 (0.63) ALDH1A1THRBLPAR2LPAR3MAPT
SCHEMBL2016893 0.85 ALDH1A1 (0.63) ALDH1A1THRBLPAR2LPAR3MAPT
SCHEMBL5175040 0.85 LPAR2 (0.64) ALDH1A1THRBLPAR2LPAR3MAPT
SCHEMBL5177092 0.85 LPAR2 (0.64) ALDH1A1THRBLPAR2LPAR3MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8362117-B2 Method for stabilizing polycarboxylates SIKA TECHNOLOGY AG (CH) 2013-01-29 — — US disclosed
US-8273808-B2 Dispersing agents for gypsum plaster compositions SIKA TECHNOLOGY AG (CH) 2012-09-25 — — US disclosed
US-20110213054-A1 METHOD FOR STABILIZING POLYCARBOXYLATES SIKA TECHNOLOGY AG (CH) 2011-09-01 — — US disclosed
US-20110160351-A1 DISPERSING AGENTS FOR GYPSUM PLASTER COMPOSITIONS SIKA TECHNOLOGY AG (CH) 2011-06-30 — — US disclosed
US-6660075-B2 Having organic groups connected by one or two carbon atoms of a C-C single or double bond that are not part of an aromatic system; reacting with maleic anhydride then hydrolyzing to form carboxylic acid groups DEGUSSA AG (DE) 2003-12-09 — — US disclosed
US-20020096089-A1 Having organic groups connected by one or two carbon atoms of a C-C single or double bond that are not part of an aromatic system; reacting with maleic anhydride then hydrolyzing to form carboxylic acid groups UBS LIMITED (GB) 2002-07-25 — — US disclosed
US-20010032569-A1 Carbon black DEGUSSA AG (DE) 2001-10-25 — — US disclosed
US-4978607-A CONTAINING GELATIN, MODIFIED WITH MONOFUNCTIONAL ACID DERIVATIVE, AND HARDENER, A CARBAMOYL PYRIDINIUM SALT; WITHOUT RETICULATED GRAIN AGFA-GEVAERT AKTIENGESSELLSCHAFT (DE) 1990-12-18 — — US disclosed
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