SCHEMBL7840644

SCHEMBL7840644

Nc1ccc(Br)n2nc(SCc3ccccc3)nc12

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.50
NPC1 O15118 4/20 0.50
SMN1; SMN2 Q16637 3/20 0.50
KDM1A O60341 4/20 0.44
HSD17B10 Q99714 1/20 0.44
ALOX15 P16050 2/20 0.43
ALDH1A1 P00352 1/20 0.43
HSP90AA1 P07900 1/20 0.43
CKS1B P61024 3/20 0.42
SKP2 Q13309 3/20 0.42
METAP2 P50579 1/20 0.41
POLB P06746 1/20 0.41
HPGD P15428 1/20 0.40
TSHR P16473 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
SCHEMBL7014524 0.84 RAB9A (0.47) RAB9ANPC1SMN1; SMN2KDM1AHSD17B10
SCHEMBL8825734 0.82 HSD17B10 (0.45) RAB9ANPC1SMN1; SMN2KDM1AHSD17B10
SCHEMBL7840913 0.82 RAB9A (0.48) RAB9ANPC1SMN1; SMN2KDM1AHSD17B10
SCHEMBL7017512 0.79 ALDH1A1 (0.46) RAB9ANPC1SMN1; SMN2KDM1AHSD17B10
SCHEMBL8825655 0.78 HSD17B10 (0.47) RAB9ANPC1SMN1; SMN2KDM1AHSD17B10
SCHEMBL8825669 0.76 HSD17B10 (0.45) RAB9ANPC1SMN1; SMN2KDM1AHSD17B10
SCHEMBL8825674 0.76 NPC1 (0.46) RAB9ANPC1SMN1; SMN2KDM1AHSD17B10
SCHEMBL7013765 0.75 RAB9A (0.57) RAB9ANPC1SMN1; SMN2KDM1AHSD17B10
SCHEMBL7019011 0.73 CKS1B (0.45) RAB9ANPC1SMN1; SMN2KDM1AHSD17B10
SCHEMBL7851305 0.73 ALDH1A1 (0.57) RAB9ANPC1SMN1; SMN2KDM1AHSD17B10

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-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
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