SCHEMBL7848799

SCHEMBL7848799

Clc1cc(Cl)n2nc(SCc3ccccc3)nc2c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CKS1B P61024 2/20 0.46
SKP2 Q13309 2/20 0.46
ALDH1A1 P00352 2/20 0.46
KDM1A O60341 4/20 0.45
HSD17B10 Q99714 1/20 0.45
NPC1 O15118 3/20 0.44
RAB9A P51151 3/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
PDE10A Q9Y233 2/20 0.43
L3MBTL1 Q9Y468 2/20 0.42
HPGD P15428 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
METAP2 P50579 1/20 0.42
MAPK1 P28482 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
CTSB P07858 1/20 0.41
TOP2A P11388 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
SCHEMBL8803109 0.88 KDM1A (0.42) CKS1BSKP2ALDH1A1KDM1AHSD17B10
SCHEMBL7840858 0.86 PDE10A (0.54) CKS1BSKP2ALDH1A1KDM1ANPC1
SCHEMBL7851723 0.83 HSD17B10 (0.47) CKS1BSKP2ALDH1A1KDM1AHSD17B10
SCHEMBL9834262 0.78 CKS1B (0.58) CKS1BSKP2ALDH1A1KDM1AHSD17B10
SCHEMBL9535777 0.76 ALDH1A1 (0.54) CKS1BSKP2ALDH1A1KDM1AHSD17B10
SCHEMBL28498245 0.76 CKS1B (0.77) CKS1BSKP2ALDH1A1KDM1AABCB1
SCHEMBL9534282 0.76 ALDH1A1 (0.56) CKS1BSKP2ALDH1A1KDM1ANPC1
SCHEMBL11031977 0.76 NPC1 (0.47) CKS1BSKP2ALDH1A1KDM1ANPC1
SCHEMBL7850997 0.75 PDE10A (0.65) ALDH1A1PDE10A
SCHEMBL7841650 0.75 CKS1B (0.51) CKS1BSKP2ALDH1A1KDM1AHSD17B10

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-0717743-B1 N-ARYL 1,2,4]TRIAZOLO 1,5-a]PYRIDINE-2-SULFONAMIDE HERBICIDES DOW AGROSCIENCES LLC (US) 2001-11-14 EP disclosed
EP-0972774-A2 2-Benzylthio-8-amino(1,2,4)triazolo(1,5-pyridines Dow AgroSciences LLC (US) 2000-01-19 EP disclosed
EP-0789698-B1 N-(1-ETHYL-4-PYRAZOLYL)TRIAZOLOAZINESULFONAMIDE HERBICIDES DOW AGROSCIENCES LLC (US) 1999-07-07 EP disclosed
US-5571775-A EFFECTIVE ON A BROAD SPECTRUM OF VEGETATION AT LOW APPLICATION RATES DOWELANCO (US) 1996-11-05 US disclosed
WO-1996001826-A1 N-ARYL[1,2,4]TRIAZOLO[1,5-a]PYRIDINE-2-SULFONAMIDE HERBICIDES DOWELANCO (US) 1996-01-25 WO disclosed