SCHEMBL7840913

SCHEMBL7840913

Nc1c(Br)cc(Br)n2nc(SCc3ccccc3)nc12

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.48
NPC1 O15118 3/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
KDM1A O60341 4/20 0.46
CKS1B P61024 4/20 0.45
SKP2 Q13309 4/20 0.45
ALDH1A1 P00352 1/20 0.44
HSD17B10 Q99714 1/20 0.42
ALOX15 P16050 1/20 0.42
HSP90AA1 P07900 1/20 0.41
METAP2 P50579 1/20 0.40
ABCB1 P08183 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
SCHEMBL7840644 0.82 RAB9A (0.50) RAB9ANPC1SMN1; SMN2KDM1ACKS1B
SCHEMBL8825734 0.80 HSD17B10 (0.45) RAB9ANPC1SMN1; SMN2KDM1ACKS1B
SCHEMBL7840525 0.77 KDM1A (0.48) RAB9ANPC1SMN1; SMN2KDM1ACKS1B
SCHEMBL8825655 0.76 HSD17B10 (0.47) RAB9ANPC1SMN1; SMN2KDM1ACKS1B
SCHEMBL7841650 0.75 CKS1B (0.51) RAB9ANPC1SMN1; SMN2KDM1ACKS1B
SCHEMBL8825674 0.74 NPC1 (0.46) RAB9ANPC1SMN1; SMN2KDM1ACKS1B
SCHEMBL8825669 0.74 HSD17B10 (0.45) RAB9ANPC1SMN1; SMN2KDM1ACKS1B
SCHEMBL7019011 0.74 CKS1B (0.45) RAB9ANPC1SMN1; SMN2KDM1ACKS1B
SCHEMBL7014524 0.71 RAB9A (0.47) RAB9ANPC1SMN1; SMN2KDM1ACKS1B
SCHEMBL7841610 0.71 RAB9A (0.48) RAB9ANPC1SMN1; SMN2KDM1ACKS1B

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 8 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
EP-0789698-A1 N-(1-ETHYL-4-PYRAZOLYL)TRIAZOLOAZINESULFONAMIDE HERBICIDES DOWELANCO (US) 1997-08-20 EP disclosed
WO-1997008172-A1 N-(1-ETHYL-4-PYRAZOLYL)TRIAZOLOAZINESULFONAMIDE HERBICIDES DOWELANCO (US) 1997-03-06 WO disclosed
US-5571775-A EFFECTIVE ON A BROAD SPECTRUM OF VEGETATION AT LOW APPLICATION RATES DOWELANCO (US) 1996-11-05 US disclosed
EP-0717743-A1 N-ARYL 1,2,4]TRIAZOLO 1,5-a]PYRIDINE-2-SULFONAMIDE HERBICIDES DOWELANCO (US) 1996-06-26 EP disclosed
WO-1996001826-A1 N-ARYL[1,2,4]TRIAZOLO[1,5-a]PYRIDINE-2-SULFONAMIDE HERBICIDES DOWELANCO (US) 1996-01-25 WO disclosed