SCHEMBL8972735

SCHEMBL8972735

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

nearest known ligand 0.72

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.72
POLB P06746 4/20 0.61
KMT2A Q03164 4/20 0.56
MEN1 O00255 1/20 0.52
RAB9A P51151 3/20 0.50
NPC1 O15118 2/20 0.50
LMNA P02545 2/20 0.50
HIF1A Q16665 1/20 0.50
HTT P42858 1/20 0.49
MAPT P10636 1/20 0.47
ALDH1A1 P00352 1/20 0.47

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
SCHEMBL9305843 0.84 SMN1; SMN2 (0.61) SMN1; SMN2POLBKMT2AMEN1RAB9A
SCHEMBL8972839 0.83 SMN1; SMN2 (0.64) SMN1; SMN2POLBKMT2AMEN1RAB9A
SCHEMBL11121930 0.81 SMN1; SMN2 (0.73) SMN1; SMN2POLBKMT2AMEN1RAB9A
SCHEMBL10872581 0.81 POLB (0.70) SMN1; SMN2POLBKMT2AMEN1RAB9A
SCHEMBL8972983 0.80 SMN1; SMN2 (0.60) SMN1; SMN2POLBKMT2ARAB9ANPC1
SCHEMBL10867320 0.80 SMN1; SMN2 (0.60) SMN1; SMN2POLBKMT2AMEN1RAB9A
SCHEMBL9305076 0.80 SMN1; SMN2 (0.60) SMN1; SMN2POLBKMT2AMEN1RAB9A
SCHEMBL757400 0.79 KMT2A (0.67) SMN1; SMN2POLBKMT2ARAB9ANPC1
SCHEMBL754927 0.78 SMN1; SMN2 (0.65) SMN1; SMN2POLBKMT2AMEN1RAB9A
SCHEMBL10894311 0.78 SMN1; SMN2 (0.68) SMN1; SMN2POLBKMT2AMEN1RAB9A

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 6 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
EP-0129506-A2 Heterocyclically substituted thio(cyclo)alkane polycarboxylic acids CIBA-GEIGY AG (CH) 1984-12-27 EP disclosed