SCHEMBL11124255

SCHEMBL11124255

CCCCC(NC(C)=O)S(=O)(=O)Cl

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PLA2G2C Q5R387 3/20 0.41
ALDH1A1 P00352 1/20 0.37
CA2 P00918 6/20 0.35
CA1 P00915 5/20 0.35
SIRT6 Q8N6T7 1/20 0.35
SIRT1 Q96EB6 1/20 0.35
USP2 O75604 1/20 0.35
LMNA P02545 1/20 0.35
MAPK1 P28482 1/20 0.34
PLA2G2A P14555 1/20 0.34
CA12 O43570 1/20 0.33
CA7 P43166 1/20 0.33
CA14 Q9ULX7 1/20 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
SCHEMBL11255941 0.83 PLA2G2C (0.42) PLA2G2CALDH1A1CA2CA1SIRT6
SCHEMBL3958639 0.80 KDM4E (0.33) PLA2G2CALDH1A1
SCHEMBL11129180 0.77 PLA2G2C (0.40) PLA2G2CALDH1A1CA2CA1SIRT6
SCHEMBL6547737 0.71 PLA2G2C (0.62) PLA2G2CCA2CA1PLA2G2A
SCHEMBL2760205 0.70 TAS1R3 (0.50) PLA2G2CCA2CA1MAPK1
SCHEMBL10885085 0.69 SIRT6 (0.46) PLA2G2CALDH1A1CA2CA1SIRT6
SCHEMBL13525107 0.68 SIRT6 (0.49) PLA2G2CALDH1A1CA2CA1SIRT6
SCHEMBL20211076 0.68 PLA2G2C (0.50) PLA2G2CALDH1A1CA2CA1SIRT6
SCHEMBL11506429 0.68 PLA2G2C (0.59) PLA2G2CCA2CA1PLA2G2A
SCHEMBL13715798 0.68 PLA2G2C (0.59) PLA2G2CCA2CA1MAPK1PLA2G2A

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-4487725-A Process for the preparation of N-acetylaminoarylsulfonic acids in sulfuric acid as solvent HOECHST AKTIENGESELLSCHAFT (DE) 1984-12-11 US disclosed