SCHEMBL3453468

SCHEMBL3453468

O=C(O)C(=O)NSc1nsc2ccccc12

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ EPAS1 Q99814 3/20 0.41
▸ MAPT P10636 6/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ TP53 P04637 4/20 0.36
▸ SMN1; SMN2 Q16637 2/20 0.36
▸ POLB P06746 1/20 0.36
▸ LMNA P02545 2/20 0.34
▸ RXFP1 Q9HBX9 1/20 0.34
▸ HCAR2 Q8TDS4 1/20 0.34
▸ CMA1 P23946 1/20 0.34
▸ KCNA3 P22001 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
SCHEMBL3453639 0.88 EPAS1 (0.42) EPAS1MAPTKDM4EALDH1A1HSD17B10
SCHEMBL11600529 0.70 MAPT (0.54) EPAS1MAPTKDM4EALDH1A1HSD17B10
SCHEMBL15665083 0.70 MAPT (0.42) EPAS1MAPTKDM4EALDH1A1HSD17B10
SCHEMBL6691525 0.68 MAPT (0.55) EPAS1MAPTKDM4EALDH1A1HSD17B10
SCHEMBL18485267 0.68 MAPT (0.50) EPAS1MAPTKDM4EALDH1A1HSD17B10
SCHEMBL260433 0.66 MAPT (0.52) EPAS1MAPTKDM4EALDH1A1HSD17B10
SCHEMBL1880698 0.66 ALDH1A1 (0.51) EPAS1MAPTKDM4EALDH1A1HSD17B10
SCHEMBL30856492 0.66 ALDH1A1 (0.51) EPAS1MAPTKDM4EALDH1A1HSD17B10
SCHEMBL10820879 0.66 ALDH1A1 (0.41) EPAS1MAPTKDM4EALDH1A1HSD17B10
Hydrochloric Acid SCHEMBL9036432 0.65 MAPT (0.51) EPAS1MAPTKDM4EALDH1A1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009141065-A3 (1,2-BENZISOTHIAZOL-3-YL)(THIO)CARBAMATES AND (1,2-BENZISOTHIAZOL-3-YL)(THIO)OXAMATES AND THE OXIDATION FORMS THEREOF FOR USE AS PESTICIDES BAYER CROPSCIENCE AG (DE) 2010-10-07 — — WO disclosed
WO-2009141065-A2 (1,2-BENZISOTHIAZOL-3-YL)(THIO)CARBAMATES AND (1,2-BENZISOTHIAZOL-3-YL)(THIO)OXAMATES AND THE OXIDATION FORMS THEREOF FOR USE AS PESTICIDES BAYER CROPSCIENCE AG (DE) 2009-11-26 — — WO disclosed
EP-2123159-A1 (1,2-Benzisothiazol-3-yl)(thio)carbamates and (1,2-Benzisothiazol-3-yl)(thio)oxamates and their oxidation forms as pesticides Bayer CropScience AG (DE) 2009-11-25 — — EP disclosed
EP-2123159-A1 (1,2-Benzisothiazol-3-yl)(thio)carbamates and (1,2-Benzisothiazol-3-yl)(thio)oxamates and their oxidation forms as pesticides Bayer CropScience AG (DE) 2009-11-25 — — EP disclosed
EP-2123159-A1 (1,2-Benzisothiazol-3-yl)(thio)carbamates and (1,2-Benzisothiazol-3-yl)(thio)oxamates and their oxidation forms as pesticides Bayer CropScience AG (DE) 2009-11-25 — — EP disclosed
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