SCHEMBL9832318

SCHEMBL9832318

C=CCOC(=O)c1cccc(C)c1NS(=O)(=O)c1nc2nccc(C)n2n1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.47
ALDH1A1 P00352 5/20 0.45
RXFP1 Q9HBX9 3/20 0.43
SMN1; SMN2 Q16637 2/20 0.40
NPC1 O15118 1/20 0.40
PKM P14618 1/20 0.40
RAB9A P51151 1/20 0.40
MAPT P10636 1/20 0.39
MAPK1 P28482 2/20 0.39
CYP3A4 P08684 1/20 0.39
POLB P06746 3/20 0.39
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C19 P33261 1/20 0.39
THRB P10828 1/20 0.38
RECQL P46063 1/20 0.38
TSHR P16473 1/20 0.37
ADAM17 P78536 1/20 0.36

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
SCHEMBL9831492 0.90 ALDH1A1 (0.56) L3MBTL1ALDH1A1RXFP1SMN1; SMN2NPC1
SCHEMBL9831652 0.88 TSHR (0.51) L3MBTL1ALDH1A1SMN1; SMN2CYP3A4POLB
SCHEMBL9831673 0.86 L3MBTL1 (0.50) L3MBTL1ALDH1A1RXFP1SMN1; SMN2NPC1
SCHEMBL10660903 0.86 HPGD (0.42) L3MBTL1ALDH1A1SMN1; SMN2RAB9AMAPT
SCHEMBL9832089 0.85 L3MBTL1 (0.45) L3MBTL1ALDH1A1SMN1; SMN2NPC1PKM
SCHEMBL9831973 0.85 ALDH1A1 (0.49) L3MBTL1ALDH1A1RXFP1SMN1; SMN2NPC1
SCHEMBL9832728 0.84 ALDH1A1 (0.48) L3MBTL1ALDH1A1RXFP1SMN1; SMN2NPC1
SCHEMBL9831827 0.82 ACLY (0.50) L3MBTL1ALDH1A1SMN1; SMN2NPC1PKM
SCHEMBL9833209 0.82 CYP3A4 (0.37) L3MBTL1ALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL9833398 0.82 CYP3A4 (0.39) L3MBTL1ALDH1A1SMN1; SMN2MAPTCYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0142152-B1 Novel substituted 1,2,4-triazolo- [1,5-a] pyrimidine-2-sulfonamides and compositions and methods of controlling undesired vegetation and suppressing the nitrification of ammonium nitrogen in soil THE DOW CHEMICAL COMPANY (US) 1991-03-20 EP claimed
EP-0142152-A2 Novel substituted 1,2,4-triazolo- [1,5-a] pyrimidine-2-sulfonamides and compositions and methods of controlling undesired vegetation and suppressing the nitrification of ammonium nitrogen in soil THE DOW CHEMICAL COMPANY (US) 1985-05-22 EP claimed
EP-0142152-B1 Novel substituted 1,2,4-triazolo- [1,5-a] pyrimidine-2-sulfonamides and compositions and methods of controlling undesired vegetation and suppressing the nitrification of ammonium nitrogen in soil THE DOW CHEMICAL COMPANY (US) 1991-03-20 EP disclosed
EP-0330137-A1 Intermediate compounds for the preparation of 1,2,4-triazolo [1,5-a]pyrimidine-2-sulfonamides DowElanco (US) 1989-08-30 EP disclosed
US-4755212-A Novel substituted 1,2,4-triazolo[1,5-a]pyrimidine-2-sulfonamides and compositions and method for inhibiting pollen formation in corn THE DOW CHEMICAL COMPANY (US) 1988-07-05 US disclosed
US-4741764-A SUPPRESSION OF NITRIFICATION OF AMMONIUM NITROGEN IN THE SOIL THE DOW CHEMICAL COMPANY (US) 1988-05-03 US disclosed
US-4740233-A Substituted 1,2,4-triazolo[1,5-a]-pyrimidine-2-sulfonamides and compositions and methods of controlling undesired vegetation and suppressing the nitrification of ammonium nitrogen in soil THE DOW CHEMICAL COMPANY (US) 1988-04-26 US disclosed
EP-0142152-A2 Novel substituted 1,2,4-triazolo- [1,5-a] pyrimidine-2-sulfonamides and compositions and methods of controlling undesired vegetation and suppressing the nitrification of ammonium nitrogen in soil THE DOW CHEMICAL COMPANY (US) 1985-05-22 EP disclosed