SCHEMBL9533550

SCHEMBL9533550

CSc1nc(F)cc2nc(SCc3ccccc3)nn12

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.46
ABCB1 P08183 3/20 0.45
KDM1A O60341 4/20 0.45
HSP90AA1 P07900 1/20 0.43
METAP2 P50579 1/20 0.41
HSD17B10 Q99714 1/20 0.41
NPC1 O15118 3/20 0.41
RAB9A P51151 3/20 0.41
PDE10A Q9Y233 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
CKS1B P61024 3/20 0.40
SKP2 Q13309 3/20 0.40
LMNA P02545 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
SCHEMBL9538648 0.81 ALDH1A1 (0.53) ALDH1A1ABCB1KDM1AMETAP2HSD17B10
SCHEMBL8111053 0.80 ALDH1A1 (0.46) ALDH1A1ABCB1KDM1AMETAP2HSD17B10
SCHEMBL9534491 0.76 LMNA (0.44) ALDH1A1HSP90AA1NPC1RAB9ASMN1; SMN2
SCHEMBL7850997 0.74 PDE10A (0.65) ALDH1A1PDE10A
SCHEMBL7840858 0.72 PDE10A (0.54) ALDH1A1ABCB1KDM1ANPC1RAB9A
SCHEMBL7851014 0.72 PDE10A (0.52) ALDH1A1ABCB1KDM1AMETAP2NPC1
SCHEMBL7841650 0.71 CKS1B (0.51) ALDH1A1ABCB1KDM1AMETAP2HSD17B10
SCHEMBL7848799 0.71 CKS1B (0.46) ALDH1A1ABCB1KDM1AMETAP2HSD17B10
SCHEMBL10685876 0.70 ALDH1A1 (0.51) ALDH1A1ABCB1KDM1AMETAP2HSD17B10
SCHEMBL7840628 0.70 ALDH1A1 (0.67) ALDH1A1KDM1ANPC1RAB9APDE10A

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 5 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
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