SCHEMBL9831376

SCHEMBL9831376

COC(=O)c1ccc(Cl)c(C)c1NS(=O)(=O)c1nc2nc(C)cc(C)n2n1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.53
ALDH1A1 P00352 4/20 0.47
KMT2A Q03164 3/20 0.47
MEN1 O00255 2/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
USP2 O75604 1/20 0.45
NPSR1 Q6W5P4 1/20 0.43
GLA P06280 1/20 0.42
HPGD P15428 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
MAPT P10636 1/20 0.40
POLB P06746 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40
RECQL P46063 1/20 0.40
LMNA P02545 1/20 0.39

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
SCHEMBL9832454 0.91 ALDH1A1 (0.49) TSHRALDH1A1KMT2AMEN1USP2
SCHEMBL9831282 0.91 TSHR (0.48) TSHRALDH1A1KMT2AMEN1SMN1; SMN2
SCHEMBL9831926 0.90 TSHR (0.53) TSHRALDH1A1KMT2AMEN1SMN1; SMN2
SCHEMBL9832032 0.90 TSHR (0.50) TSHRALDH1A1KMT2AMEN1SMN1; SMN2
SCHEMBL9832066 0.90 TSHR (0.55) TSHRALDH1A1KMT2AMEN1SMN1; SMN2
SCHEMBL9830358 0.88 TSHR (0.58) TSHRALDH1A1KMT2AMEN1SMN1; SMN2
SCHEMBL9830619 0.87 ALDH1A1 (0.43) TSHRALDH1A1KMT2AMEN1SMN1; SMN2
SCHEMBL8354997 0.84 TSHR (0.60) TSHRALDH1A1KMT2AMEN1SMN1; SMN2
SCHEMBL9832013 0.83 MAPT (0.35) TSHRALDH1A1SMN1; SMN2NPSR1HPGD
SCHEMBL9830997 0.83 TSHR (0.54) TSHRALDH1A1KMT2AMEN1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0140709-B1 5-LIPOXYGENASE INHIBITORS MERCK FROSST CANADA INC. (CA) 1991-04-03 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 claimed
US-4634766-A LIPOXYGENASE INHIBITORS MERCK FROSST CANADA, INC. (CA) 1987-01-06 US 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-0140709-A2 5-Lipoxygenase inhibitors MERCK FROSST CANADA INC. (CA) 1985-05-08 EP claimed
EP-0140709-B1 5-LIPOXYGENASE INHIBITORS MERCK FROSST CANADA INC. (CA) 1991-04-03 EP disclosed
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
US-4634766-A LIPOXYGENASE INHIBITORS MERCK FROSST CANADA, INC. (CA) 1987-01-06 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
EP-0140709-A2 5-Lipoxygenase inhibitors MERCK FROSST CANADA INC. (CA) 1985-05-08 EP disclosed