SCHEMBL9535561

SCHEMBL9535561

CSc1nc(Br)cc2nnc(SCc3ccccc3)n12

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.44
RAB9A P51151 3/20 0.43
KDM4E B2RXH2 2/20 0.43
ATM Q13315 1/20 0.43
MAPT P10636 3/20 0.41
POLB P06746 1/20 0.41
ALDH1A1 P00352 5/20 0.41
ALOX15 P16050 1/20 0.41
TSHR P16473 1/20 0.41
MAPK1 P28482 1/20 0.41
HTT P42858 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
THRB P10828 2/20 0.39
NPC1 O15118 2/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
HSP90AA1 P07900 1/20 0.38

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
SCHEMBL9535707 0.86 ALDH1A1 (0.48) LMNARAB9AKDM4EATMMAPT
SCHEMBL9536889 0.85 LMNA (0.44) LMNARAB9AKDM4EMAPTPOLB
SCHEMBL9534491 0.85 LMNA (0.44) LMNARAB9AKDM4EMAPTPOLB
SCHEMBL9537059 0.77 LMNA (0.47) LMNARAB9AKDM4EALDH1A1ALOX15
SCHEMBL11779182 0.69 THRB (0.67) LMNARAB9AKDM4EMAPTPOLB
SCHEMBL8945250 0.68 ALDH1A1 (0.50) LMNARAB9AKDM4EMAPTPOLB
SCHEMBL8111879 0.68 MAPT (0.43) LMNARAB9AKDM4EMAPTPOLB
SCHEMBL8945165 0.68 RAB9A (0.41) LMNARAB9AKDM4EALDH1A1ALOX15
SCHEMBL10845465 0.68 LMNA (0.51) LMNARAB9AKDM4EMAPTPOLB
SCHEMBL9536661 0.67 ALDH1A1 (0.44) LMNARAB9AKDM4EPOLBALDH1A1

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-0343752-B1 Alkoxy-1,2,4-triazolo (1,5-c) pyrimidine-2-sulfonamides, process for their preparation and intermediates DOWELANCO (US) 1993-12-01 EP disclosed
US-5163995-A For use with grassy crops and soybeans DOWELANCO (US) 1992-11-17 US disclosed
WO-1989011782-A1 ALKOXY-1,2,4-TRIAZOLO[1,5-c]PYRIMIDINE-2-SULFONAMIDES, PROCESS FOR THEIR PREPARATION AND INTERMEDIATES THE DOW CHEMICAL COMPANY (US) 1989-12-14 WO disclosed
EP-0343752-A1 Alkoxy-1,2,4-triazolo (1,5-c) pyrimidine-2-sulfonamides, process for their preparation and intermediates DowElanco (US) 1989-11-29 EP disclosed