SCHEMBL11544799

SCHEMBL11544799

Cc1ccc(C)n1-c1cc(C(=O)O)cc(S(N)(=O)=O)c1Oc1ccccc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 3/20 0.68
KDM4E B2RXH2 2/20 0.68
USP2 O75604 2/20 0.68
ALDH1A1 P00352 2/20 0.68
LMNA P02545 2/20 0.68
HPGD P15428 2/20 0.68
HIF1A Q16665 2/20 0.68
SLC6A4 P31645 1/20 0.68
CA2 P00918 1/20 0.54
TSHR P16473 1/20 0.54
BLM P54132 1/20 0.54
SLC12A2 P55011 1/20 0.54
NPSR1 Q6W5P4 1/20 0.54
MYC P01106 9/20 0.46
PTGS2 P35354 3/20 0.45
PKM P14618 1/20 0.44
ESR1 P03372 1/20 0.41
ALOX15 P16050 1/20 0.41
PTPN7 P35236 1/20 0.41
NR4A1 P22736 2/20 0.40

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
SCHEMBL11546942 0.83 LMNA (0.91) HSD17B10KDM4EUSP2ALDH1A1LMNA
SCHEMBL2741894 0.83 HSD17B10 (0.71) HSD17B10KDM4EUSP2ALDH1A1LMNA
SCHEMBL2741893 0.82 KDM4E (0.62) HSD17B10KDM4EUSP2ALDH1A1LMNA
SCHEMBL11548130 0.82 LMNA (0.80) HSD17B10KDM4EUSP2ALDH1A1LMNA
SCHEMBL10998669 0.81 ALDH1A1 (0.65) HSD17B10KDM4EUSP2ALDH1A1LMNA
Piretanide SCHEMBL30230376 0.81 KDM4E (1.00) HSD17B10KDM4EUSP2ALDH1A1LMNA
Piretanide SCHEMBL49473 0.81 KDM4E (1.00) HSD17B10KDM4EUSP2ALDH1A1LMNA
Piretanide SCHEMBL1741994 0.81 KDM4E (1.00) HSD17B10KDM4EUSP2ALDH1A1LMNA
SCHEMBL11542770 0.81 KDM4E (0.95) HSD17B10KDM4EUSP2ALDH1A1LMNA
SCHEMBL10998437 0.81 ALDH1A1 (0.67) HSD17B10KDM4EUSP2ALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4176190-A Diuretic and saliuretic sulphamoylbenzoic acids CIBA-GEIGY CORPORATION (US) 1979-11-27 US disclosed