SCHEMBL9831992

SCHEMBL9831992

COC(=O)c1c(C)ccc(C)c1NS(=O)(=O)c1nc2nc(C)cc(C)n2n1

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.57
ALDH1A1 P00352 3/20 0.48
USP2 O75604 1/20 0.48
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
L3MBTL1 Q9Y468 1/20 0.43
GLA P06280 1/20 0.42
RECQL P46063 1/20 0.42
LMNA P02545 1/20 0.42
POLB P06746 1/20 0.42
NPSR1 Q6W5P4 1/20 0.41
HSD17B10 Q99714 1/20 0.41
PKM P14618 1/20 0.41

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
SCHEMBL9831537 0.91 TSHR (0.52) TSHRALDH1A1USP2MEN1KMT2A
SCHEMBL9833972 0.90 TSHR (0.54) TSHRALDH1A1USP2MEN1KMT2A
SCHEMBL9833021 0.90 TSHR (0.51) TSHRALDH1A1USP2MEN1KMT2A
SCHEMBL10667989 0.87 TSHR (0.43) TSHRALDH1A1USP2SMN1; SMN2L3MBTL1
SCHEMBL9830997 0.86 TSHR (0.54) TSHRALDH1A1USP2MEN1KMT2A
SCHEMBL9831239 0.86 L3MBTL1 (0.45) TSHRALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL9832066 0.85 TSHR (0.55) TSHRALDH1A1USP2MEN1KMT2A
SCHEMBL8354997 0.85 TSHR (0.60) TSHRALDH1A1USP2MEN1KMT2A
SCHEMBL9831168 0.81 TSHR (0.36) TSHRALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL9832114 0.81 TSHR (0.66) TSHRALDH1A1USP2SMN1; SMN2RECQL

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 7 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
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