SCHEMBL10967749

SCHEMBL10967749

Cc1cc[c]c(OCC(=O)S)c1

nearest known ligand 0.33

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 3/20 0.33
▸ LMNA P02545 2/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ PTGDR2 Q9Y5Y4 1/20 0.32
▸ GAA P10253 3/20 0.31
▸ KMT2A Q03164 3/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ NLRP3 Q96P20 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ MEN1 O00255 2/20 0.31
▸ USP2 O75604 1/20 0.31
▸ FFAR1 O14842 1/20 0.31
▸ MAPK1 P28482 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
SCHEMBL9787031 0.78 NPC1 (0.47) TDP1LMNANPC1L3MBTL1KMT2A
SCHEMBL11513183 0.74 NQO1 (0.36) TDP1LMNAL3MBTL1KMT2ASMN1; SMN2
SCHEMBL27997482 0.74 ALDH1A1 (0.35) TDP1L3MBTL1PTGDR2GAAKMT2A
SCHEMBL8009351 0.73 — —
SCHEMBL2079650 0.72 LMNA (0.47) LMNANPC1HTTGAASMN1; SMN2
SCHEMBL11850996 0.72 ALDH1A1 (0.36) TDP1NPC1L3MBTL1HTTGAA
SCHEMBL7997628 0.72 PTPN1 (0.35) TDP1L3MBTL1KMT2AMEN1USP2
SCHEMBL9998500 0.70 LTA4H (0.35) TDP1LMNANPC1L3MBTL1HTT
SCHEMBL22650 0.69 POLB (0.36) LMNAL3MBTL1HTTGAASMN1; SMN2
SCHEMBL15069616 0.69 ALDH1A1 (0.39) LMNAGAATSHRMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0075117-B1 2H-1,2,4,6-THIATRIAZINE-1,1-DIOXIDES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS HERBICIDES BASF Aktiengesellschaft (DE) 1985-03-13 — — EP disclosed
US-4428766-A 2N-1,2,4,6,Thiatriazine-1,1-dioxides and their use for controlling undesirable plant growth BASF AKTIENGESELLSCHAFT (DE) 1984-01-31 — — US disclosed
EP-0075117-A2 2H-1,2,4,6-thiatriazine-1,1-dioxides, process for their preparation and their use as herbicides BASF Aktiengesellschaft (DE) 1983-03-30 — — EP disclosed
US-4343648-A 6H-1,2,4,6-THIATRIAZINE-1,1-DIOXIDES BASF AKTIENGESELLSCHAFT (DE) 1982-08-10 — — US disclosed
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