SCHEMBL7299303

SCHEMBL7299303

[c]1nnc(-c2cnccn2)o1

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.37
TERT O14746 4/20 0.35
PIEZO1 Q92508 7/20 0.35
NISCH Q9Y2I1 1/20 0.34
NPC1 O15118 1/20 0.34
PKM P14618 1/20 0.34
RAB9A P51151 1/20 0.34
HSD17B10 Q99714 1/20 0.34
MEN1 O00255 1/20 0.32
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32
KMT2A Q03164 1/20 0.32
P2RX7 Q99572 1/20 0.32
CYP1A2 P05177 1/20 0.32
HSP90AA1 P07900 1/20 0.31

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
SCHEMBL78566 0.68 NISCH (0.50) KDM4ENISCHNPC1PKMRAB9A
SCHEMBL29598957 0.68 NISCH (0.50) KDM4ENISCHNPC1PKMRAB9A
SCHEMBL29454745 0.68 NISCH (0.50) KDM4ENISCHNPC1PKMRAB9A
SCHEMBL6051817 0.67 NOTUM (0.41) KDM4ETERTPIEZO1NISCHNPC1
SCHEMBL9794662 0.66 NISCH (0.48) KDM4ENISCHNPC1PKMRAB9A
SCHEMBL31372462 0.66 NISCH (0.48) KDM4ENISCHNPC1PKMRAB9A
SCHEMBL14053846 0.66 NISCH (0.48) KDM4ENISCHNPC1PKMRAB9A
Hydrochloric Acid SCHEMBL3640139 0.66 NISCH (0.48) KDM4ENISCHNPC1PKMRAB9A
SCHEMBL982756 0.65 HPGDS (0.39) KDM4ETERTPIEZO1NISCHNPC1
SCHEMBL15599488 0.65 KDM4E (0.50) KDM4ETERTPIEZO1HSD17B10MEN1

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5371074-A Use of saccharin derivatives as proteolytic enzyme inhibitors STERLING WINTHROP INC. (US) 1994-12-06 US claimed
EP-0542372-A1 2-Substituted saccharin derivative proteolytic enzyme inhibitors STERLING WINTHROP INC. (US) 1993-05-19 EP claimed
US-5773456-A EMPHYSEMA, RHEUMATOID ARTHRITIS AND PANCREATITIS SANOFI (FR) 1998-06-30 US disclosed
US-5578623-A DRUGS FOR TREATMENT OF ARTHRITIS, PANCREATITIS, CYSTIC FIBROSIS, BRONCHITIS, RESPIRATORY DISORDERS STERLING WINTHROP INC. (US) 1996-11-26 US disclosed
US-5464852-A Used in treatment of degenerative diseases STERLING WINTHROP INC. (US) 1995-11-07 US disclosed
US-5380737-A Enzyme inhibitors STERLING WINTHROP INC. (US) 1995-01-10 US disclosed
EP-0542371-A1 Saccharin derivative proteolytic enzyme inhibitors STERLING WINTHROP INC. (US) 1993-05-19 EP disclosed