SCHEMBL9832174

SCHEMBL9832174

COCc1cccc(F)c1NS(=O)(=O)c1nc2ncc(C)cn2n1

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 2/20 0.35
APLNR P35414 1/20 0.35
TSHR P16473 1/20 0.34
SCN1A P35498 1/20 0.33
SCN5A Q14524 1/20 0.33
SCN8A Q9UQD0 1/20 0.33
P2RX7 Q99572 1/20 0.31
CCR4 P51679 1/20 0.31
SLC40A1 Q9NP59 1/20 0.31
GAA P10253 1/20 0.31
MAPK1 P28482 1/20 0.31
KMT2A Q03164 1/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL9833369 0.88 SLC40A1 (0.36) GRM5TSHRSLC40A1GAAMAPK1
SCHEMBL9831323 0.88 TSHR (0.34) TSHRCCR4
SCHEMBL9831402 0.85 TSHR (0.36) GRM5TSHRSLC40A1
SCHEMBL10664258 0.85 SMN1; SMN2 (0.37) TSHRSCN1ASCN5ASCN8ASLC40A1
SCHEMBL8356736 0.83 SLC40A1 (0.36) CCR4SLC40A1
SCHEMBL9830333 0.83 KMT2A (0.37) SLC40A1MAPK1KMT2A
SCHEMBL9831928 0.83 TSHR (0.38) TSHRSCN1ASCN5ASCN8AP2RX7
SCHEMBL9832055 0.82 SLC22A12 (0.35) TSHRCCR4KMT2A
SCHEMBL9831623 0.81 TSHR (0.43) TSHRGAAKMT2A
SCHEMBL9831564 0.81 TSHR (0.42) TSHRKMT2ASMN1; 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 4 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
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