SCHEMBL9536661

SCHEMBL9536661

CSc1ncc(Cl)c2nnc(SCc3ccccc3)n12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.44
LMNA P02545 5/20 0.44
HTT P42858 4/20 0.43
POLB P06746 2/20 0.43
RAB9A P51151 3/20 0.42
HSP90AA1 P07900 2/20 0.41
NPSR1 Q6W5P4 1/20 0.41
KDM4E B2RXH2 2/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
NPC1 O15118 2/20 0.41
TSHR P16473 4/20 0.41
MAPK1 P28482 2/20 0.41
ALOX15 P16050 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C9 P11712 1/20 0.40

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
SCHEMBL9537059 0.75 LMNA (0.47) ALDH1A1LMNAHTTRAB9AKDM4E
SCHEMBL8945165 0.73 RAB9A (0.41) ALDH1A1LMNAHTTRAB9AKDM4E
SCHEMBL9536889 0.72 LMNA (0.44) ALDH1A1LMNAHTTPOLBRAB9A
SCHEMBL8945250 0.71 ALDH1A1 (0.50) ALDH1A1LMNAHTTPOLBRAB9A
SCHEMBL9535707 0.68 ALDH1A1 (0.48) ALDH1A1LMNAHTTPOLBRAB9A
SCHEMBL8102926 0.68 ALDH1A1 (0.43) ALDH1A1LMNARAB9ANPSR1KDM4E
SCHEMBL9535561 0.67 LMNA (0.44) ALDH1A1LMNAHTTPOLBRAB9A
SCHEMBL9534491 0.67 LMNA (0.44) ALDH1A1LMNAHTTPOLBRAB9A
SCHEMBL28852423 0.64 HTT (0.52) ALDH1A1LMNAHTTPOLBRAB9A
SCHEMBL6406874 0.63 LMNA (0.65) ALDH1A1LMNAHTTRAB9AHSP90AA1

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-5010195-A From 5-alkoxy-1,2,4-triazolo(1,5-c)pyrimidine THE DOW CHEMICAL COMPANY (US) 1991-04-23 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