SCHEMBL8972983

SCHEMBL8972983

O=C(O)CC(C(=O)O)C(Sc1nc2ccccc2[nH]1)C(=O)O

nearest known ligand 0.60

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.60
KMT2A Q03164 2/20 0.59
POLB P06746 2/20 0.50
LMNA P02545 3/20 0.47
NPC1 O15118 6/20 0.46
RAB9A P51151 6/20 0.46
BCHE P06276 1/20 0.46
HPGD P15428 1/20 0.45
MAPT P10636 1/20 0.45
EPHX2 P34913 1/20 0.45
HSD17B10 Q99714 1/20 0.44

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
SCHEMBL10640951 0.91 SMN1; SMN2 (0.56) SMN1; SMN2KMT2APOLBLMNANPC1
SCHEMBL9305843 0.88 SMN1; SMN2 (0.61) SMN1; SMN2KMT2APOLBLMNANPC1
SCHEMBL8972839 0.87 SMN1; SMN2 (0.64) SMN1; SMN2KMT2APOLBLMNANPC1
SCHEMBL10867320 0.87 SMN1; SMN2 (0.60) SMN1; SMN2KMT2APOLBLMNANPC1
SCHEMBL757400 0.87 KMT2A (0.67) SMN1; SMN2KMT2APOLBLMNANPC1
SCHEMBL9306658 0.85 SMN1; SMN2 (0.57) SMN1; SMN2KMT2APOLBLMNANPC1
SCHEMBL9305076 0.84 SMN1; SMN2 (0.60) SMN1; SMN2KMT2APOLBLMNANPC1
SCHEMBL9304705 0.82 KMT2A (0.67) SMN1; SMN2KMT2APOLBLMNANPC1
SCHEMBL10764336 0.82 KMT2A (0.67) SMN1; SMN2KMT2APOLBLMNANPC1
SCHEMBL9308094 0.82 SMN1; SMN2 (0.57) SMN1; SMN2KMT2APOLBLMNANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5549847-A STIRRING A FILTER CAKE OF CORROSION INHIBITOR WITH DISPERSANT AND THICKENER; STORAGE STABILITY CIBA-GEIGY CORPORATION (US) 1996-08-27 US disclosed
EP-0511163-B1 Pourable aqueous dispersions of polycarboxylic acid corrosion inhibitors CIBA GEIGY AG (CH) 1995-07-26 EP disclosed
US-5347008-A Thio(cyclo) alkanepolycarboxylic acids containing heterocyclic substituents CIBA-GEIGY CORPORATION (US) 1994-09-13 US disclosed
EP-0511163-A1 Pourable aqueous dispersions of polycarboxylic acid corrosion inhibitors CIBA-GEIGY AG (CH) 1992-10-28 EP disclosed
US-5152929-A Corrosion inhibitors for water systems CIBA-GEIGY CORPORATION (US) 1992-10-06 US disclosed
US-4612049-A BENZOTHI ZOLYL THIO-, BENZIMIDAZOLYLTHIO- OR BENZOXAZOLYLTHIO-SUBSTITUTED CARBOXY ACID CIBA-GEIGY CORPORATION (US) 1986-09-16 US disclosed
EP-0183647-A1 Anti-corrosive aqueous paints CIBA-GEIGY AG (CH) 1986-06-04 EP disclosed
EP-0129506-A2 Heterocyclically substituted thio(cyclo)alkane polycarboxylic acids CIBA-GEIGY AG (CH) 1984-12-27 EP disclosed
EP-0128862-A2 Anti-corrosive coating composition CIBA-GEIGY AG (CH) 1984-12-19 EP disclosed