SCHEMBL7841559

SCHEMBL7841559

COc1ccc(Cl)c2nc(SCc3ccccc3)nn12

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.57
CKS1B P61024 3/20 0.44
SKP2 Q13309 3/20 0.44
RAB9A P51151 4/20 0.43
NPC1 O15118 3/20 0.43
KDM1A O60341 3/20 0.42
METAP2 P50579 1/20 0.41
HSD17B10 Q99714 1/20 0.41
KMT2A Q03164 2/20 0.41
KDM4E B2RXH2 1/20 0.39
TP53 P04637 1/20 0.39
GAA P10253 1/20 0.39
MAPT P10636 1/20 0.39
HPGD P15428 1/20 0.39
NFKB1 P19838 1/20 0.39
NFKB2 Q00653 1/20 0.39
RELA Q04206 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39

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
SCHEMBL7851305 0.85 ALDH1A1 (0.57) ALDH1A1CKS1BSKP2RAB9ANPC1
SCHEMBL7016232 0.83 HSD17B10 (0.46) ALDH1A1CKS1BSKP2RAB9ANPC1
SCHEMBL8111887 0.81 ALDH1A1 (0.49) ALDH1A1CKS1BSKP2RAB9ANPC1
SCHEMBL9641291 0.78 ALDH1A1 (0.51) ALDH1A1CKS1BSKP2RAB9ANPC1
SCHEMBL7849961 0.78 ALDH1A1 (0.51) ALDH1A1CKS1BSKP2RAB9ANPC1
SCHEMBL9535407 0.77 ALDH1A1 (0.50) ALDH1A1CKS1BSKP2RAB9ANPC1
SCHEMBL9642157 0.77 ALDH1A1 (0.56) ALDH1A1CKS1BSKP2RAB9ANPC1
SCHEMBL9539074 0.77 ALDH1A1 (0.53) ALDH1A1CKS1BSKP2RAB9ANPC1
SCHEMBL9641712 0.75 RAB9A (0.43) ALDH1A1CKS1BSKP2RAB9ANPC1
SCHEMBL9534369 0.75 ALDH1A1 (0.48) ALDH1A1CKS1BSKP2RAB9ANPC1

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