SCHEMBL7848797

SCHEMBL7848797

CCOc1ncccc1NC(=O)OC(C)(C)C

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
METAP1 P53582 1/20 0.52
L3MBTL1 Q9Y468 2/20 0.50
GAA P10253 2/20 0.48
KMT2A Q03164 3/20 0.47
MEN1 O00255 1/20 0.47
NPC1 O15118 1/20 0.45
TSHR P16473 1/20 0.45
P2RY1 P47900 2/20 0.43
CYP17A1 P05093 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
BRD4 O60885 1/20 0.43
ALDH1A1 P00352 2/20 0.43
PPARG P37231 1/20 0.42
RXFP1 Q9HBX9 1/20 0.42
NCOR2 Q9Y618 1/20 0.42
HPGD P15428 1/20 0.41
NAMPT P43490 1/20 0.41
SLC13A5 Q86YT5 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
SCHEMBL1723318 0.86 METAP1 (0.54) METAP1P2RY1CYP17A1ALDH1A1RXFP1
SCHEMBL30283184 0.86 METAP1 (0.54) METAP1P2RY1CYP17A1ALDH1A1RXFP1
SCHEMBL23482029 0.82 METAP1 (0.53) METAP1CYP17A1BRD4RXFP1NAMPT
SCHEMBL7850023 0.81 L3MBTL1 (0.56) L3MBTL1GAAKMT2AMEN1NPC1
SCHEMBL4906896 0.80 BRD4 (0.70) METAP1GAANPC1P2RY1CYP1A2
SCHEMBL2392457 0.80 METAP1 (0.56) METAP1KMT2AMEN1CYP17A1BRD4
SCHEMBL3243855 0.80 METAP1 (0.56) METAP1CYP17A1BRD4RXFP1NAMPT
SCHEMBL6868944 0.80 METAP1 (0.56) METAP1KMT2AMEN1CYP17A1RXFP1
SCHEMBL15266282 0.80 METAP1 (0.56) METAP1P2RY1CYP17A1RXFP1NAMPT
SCHEMBL30668778 0.80 METAP1 (0.56) METAP1CYP17A1BRD4RXFP1NAMPT

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
US-5700940-A FOR PRE- OR POSTEMERGENCE SPRAYING OF PLANTS OR SOILS DOWELANCO (US) 1997-12-23 US disclosed
US-5614469-A N-pyridinyl[1,2,4]triazolo[1,5-c]pyrimidine-2-sulfonamide herbicides DOWELANCO (US) 1997-03-25 US disclosed
US-5571775-A EFFECTIVE ON A BROAD SPECTRUM OF VEGETATION AT LOW APPLICATION RATES DOWELANCO (US) 1996-11-05 US disclosed
EP-0717745-A1 N-PYRIDINYL 1,2,4]TRIAZOLO 1,5-C]PYRIMIDINE-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
WO-1996001828-A1 N-PYRIDINYL[1,2,4]TRIAZOLO[1,5-C]PYRIMIDINE-2-SULFONAMIDE HERBICIDES DOWELANCO (US) 1996-01-25 WO disclosed