SCHEMBL9750994

SCHEMBL9750994

O=C(O)C(O)C(C(=O)O)S(=O)(=O)O

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.47
SRC P12931 2/20 0.33
CYP2C9 P11712 1/20 0.32
PDE4A P27815 1/20 0.32
TP53 P04637 1/20 0.32

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
SCHEMBL11523874 0.97 TSHR (0.45) TSHRSRCCYP2C9PDE4ATP53
SCHEMBL1129743 0.82 SRC (0.39) TSHRSRCCYP2C9TP53
SCHEMBL1952008 0.79 SRC (0.37) TSHRSRCCYP2C9TP53
SCHEMBL11763691 0.79 SRC (0.37) TSHRSRCCYP2C9TP53
SCHEMBL2521506 0.79 SRC (0.37) TSHRSRCCYP2C9TP53
Ammonia Solution, Strong SCHEMBL11741344 0.79 SRC (0.37) TSHRSRCCYP2C9TP53
SCHEMBL28489480 0.79 SRC (0.37) TSHRSRCCYP2C9TP53
Ammonia Solution, Strong SCHEMBL11776049 0.79 SRC (0.37) TSHRSRCCYP2C9TP53
SCHEMBL11633697 0.76 SLC7A5 (0.42) SRC
Cadaverine Tartrate SCHEMBL988008 0.76 TSHR (0.71) TSHRSRCCYP2C9PDE4ATP53

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 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4167561-A ALKALI METAL A-HYDROXY-B-SULFOSUCCINATES LEVER BROTHERS COMPANY (US) 1979-09-11 US claimed
US-RE29576-E Sulfosuccinate derivatives as detergent builders LEVER BROTHERS COMPANY (US) 1978-03-14 US claimed
JP-56003695-A None JP disclosed
EP-0396739-A4 HYPOCHLORITE COMPOSITIONS CONTAINING THIOSULFATE AND USE THEREOF 1991-04-24 EP disclosed
EP-0396739-A1 HYPOCHLORITE COMPOSITIONS CONTAINING THIOSULFATE AND USE THEREOF BRANDEIS UNIVERSITY (US) 1990-11-14 EP disclosed
WO-1990005529-A1 HYPOCHLORITE COMPOSITIONS CONTAINING THIOSULFATE AND USE THEREOF BRANDEIS UNIVERSITY (US) 1990-05-31 WO disclosed
US-4908215-A Hypochlorite, alkali or alkaline earth metal thiosulfate; for disinfecting, bleaching, cleansing BRANDEIS UNIVERSITY (US) 1990-03-13 US disclosed
JP-S563695-A TREATMENT OF ELECTROLYTIC COLORING OF ALUMINUM SHIRATORI SEIYAKU KK 1981-01-14 JP disclosed
US-4167561-A ALKALI METAL A-HYDROXY-B-SULFOSUCCINATES LEVER BROTHERS COMPANY (US) 1979-09-11 US disclosed
US-4167561-A ALKALI METAL A-HYDROXY-B-SULFOSUCCINATES LEVER BROTHERS COMPANY (US) 1979-09-11 US disclosed
US-RE29576-E Sulfosuccinate derivatives as detergent builders LEVER BROTHERS COMPANY (US) 1978-03-14 US disclosed
US-3987043-A SULFOSUCCINATE DERIVATIVES AS DETERGENT BUILDERS LEVER BROTHERS COMPANY (US) 1976-10-19 US disclosed
US-3984408-A Sulfosuccinate derivatives as detergent builders LEVER BROTHERS COMPANY (US) 1976-10-05 US disclosed
US-3976642-A Sulfosuccinate derivatives as detergent builders LEVER BROTHERS COMPANY (US) 1976-08-24 US disclosed
US-3970653-A Sulfosuccinate derivatives as detergent builders LEVER BROTHERS COMPANY (US) 1976-07-20 US disclosed
US-3968110-A PHENYL LEVER BROTHERS COMPANY (US) 1976-07-06 US disclosed
US-3957775-A SULFOSUCCINATE DERIVATIVES AS DETERGENT BUILDERS LEVER BROTHERS COMPANY (US) 1976-05-18 US disclosed
US-3950331-A SULFOSUCCINATE DERIVATIVES AS DETERGENT BUILDERS LEVER BROTHERS COMPANY (US) 1976-04-13 US disclosed
US-3936448-A DETERGENTS, BUILDERS LEVER BROTHERS COMPANY (US) 1976-02-03 US disclosed
US-3935206-A Sulfosuccinate derivatives as detergent builders LEVER BROTHERS COMPANY (US) 1976-01-27 US disclosed