SCHEMBL11049434

SCHEMBL11049434

Cc1cc(S(=O)(=O)O)oc1C.[NaH]

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HPGD P15428 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
TAS1R3 Q7RTX0 1/20 0.31
TAS1R1 Q7RTX1 1/20 0.31

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
SCHEMBL22465826 0.78 LIPG (0.33) ALDH1A1HPGD
SCHEMBL11049449 0.74 LMNA (0.42) ALDH1A1SMN1; SMN2
SCHEMBL11050586 0.67 TDP1 (0.43) NPC1ALDH1A1HPGDRAB9ASMN1; SMN2
SCHEMBL3468425 0.64 TDP1 (0.46) NPC1ALDH1A1HPGDRAB9ASMN1; SMN2
SCHEMBL13826361 0.63 CA1 (0.46) ALDH1A1SMN1; SMN2
Hydrochloric Acid SCHEMBL11049903 0.62 TDP1 (0.43) NPC1ALDH1A1HPGDRAB9ASMN1; SMN2
SCHEMBL1299653 0.62 MAPT (0.38) NPC1ALDH1A1HPGDRAB9ASMN1; SMN2
SCHEMBL2864849 0.62 LMNA (0.46) ALDH1A1HPGDSMN1; SMN2
Hydrochloric Acid SCHEMBL27758706 0.61 MAPT (0.37) NPC1ALDH1A1HPGDRAB9ASMN1; SMN2
SCHEMBL11115011 0.61 GAA (0.36) NPC1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4430355-A ARTIFICIAL SWEETENER DR. KARL THOMAE GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1984-02-07 US disclosed
US-4233333-A 4,5-Dimethyl-thieno[3,2-d]isothiazolo-3(2H)-one-1,1-dioxides, compositions, and methods of use as a sweetener BOEHRINGER INGELHEIM GMBH (DE) 1980-11-11 US disclosed