SCHEMBL7849985

SCHEMBL7849985

CCOc1cc(Cl)cn2nc(SCc3ccccc3)nc12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 1/20 0.48
NPC1 O15118 5/20 0.45
RAB9A P51151 5/20 0.45
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
NR2E3 Q9Y5X4 1/20 0.42
HSD17B10 Q99714 1/20 0.40
ALDH1A1 P00352 2/20 0.40
SMN1; SMN2 Q16637 4/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
HPGD P15428 2/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
METAP2 P50579 1/20 0.39
EGFR P00533 1/20 0.38
MAPT P10636 1/20 0.38
TDP1 Q9NUW8 1/20 0.38

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
SCHEMBL7851079 0.88 PDE10A (0.50) PDE10ANPC1RAB9AMEN1KMT2A
SCHEMBL8138083 0.82 PDE10A (0.52) PDE10ANPC1RAB9AMEN1KMT2A
SCHEMBL7842366 0.74 ALDH1A1 (0.46) NPC1RAB9AMEN1KMT2AHSD17B10
SCHEMBL9833126 0.72 NPC1 (0.67) PDE10ANPC1RAB9AMEN1KMT2A
SCHEMBL9641712 0.71 RAB9A (0.43) NPC1RAB9AMEN1KMT2ANR2E3
SCHEMBL9641303 0.71 ALDH1A1 (0.43) NPC1RAB9ANR2E3HSD17B10ALDH1A1
SCHEMBL9832945 0.71 NPC1 (0.62) PDE10ANPC1RAB9AMEN1KMT2A
SCHEMBL7841610 0.69 RAB9A (0.48) PDE10ANPC1RAB9AMEN1KMT2A
SCHEMBL9831324 0.69 RAB9A (0.61) PDE10ANPC1RAB9AMEN1KMT2A
SCHEMBL9536270 0.69 ALDH1A1 (0.46) PDE10ANPC1RAB9AHSD17B10ALDH1A1

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