SCHEMBL7611053

SCHEMBL7611053

Cc1ccncc1-c1nsnc1Cl

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MPI P34949 1/20 0.41
CYP11B1 P15538 6/20 0.40
CYP11B2 P19099 6/20 0.40
PTGS2 P35354 2/20 0.40
CYP1A2 P05177 6/20 0.39
CYP2E1 P05181 2/20 0.39
CYP3A4 P08684 2/20 0.39
CYP2C8 P10632 2/20 0.39
CYP2D6 P10635 2/20 0.39
CYP2A6 P11509 2/20 0.39
CYP2C9 P11712 2/20 0.39
CYP2B6 P20813 2/20 0.39
CYP2C19 P33261 2/20 0.39
CYP17A1 P05093 6/20 0.37
PDE2A O00408 1/20 0.35
PDE10A Q9Y233 1/20 0.35
CDC25B P30305 1/20 0.34
ABL1 P00519 1/20 0.34

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
SCHEMBL7609569 0.77 CYP11B1 (0.43) CYP11B1CYP11B2CYP1A2CYP2E1CYP3A4
Iodide SCHEMBL7616149 0.76 CYP11B1 (0.42) CYP11B1CYP11B2CYP1A2CYP2E1CYP3A4
SCHEMBL7817896 0.76 CDC25B (0.32) CDC25B
SCHEMBL3421743 0.72 TDO2 (0.49) CYP11B1CYP11B2PTGS2CYP1A2CYP2E1
SCHEMBL29988790 0.72 TDO2 (0.49) CYP11B1CYP11B2PTGS2CYP1A2CYP2E1
SCHEMBL6078239 0.70 NOTUM (0.42) CYP3A4CYP2A6
SCHEMBL9393916 0.70 MAPT (0.42) CYP1A2CYP3A4CYP2D6CYP2C9CYP2C19
SCHEMBL4031583 0.68 CYP2A6 (0.50) CYP1A2CYP2E1CYP3A4CYP2D6CYP2A6
SCHEMBL28109293 0.67 CYP11B1 (0.50) CYP11B1CYP11B2PTGS2CYP17A1PDE2A
SCHEMBL22828751 0.66 CYP2A6 (0.59) CYP11B1CYP11B2PTGS2CYP1A2CYP2A6

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 24 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0734259-B1 Use of piperidine compounds in the treatment of schizophrenia NOVO NORDISK AS (DK) 2002-06-12 EP disclosed
EP-0793665-B1 HETEROCYCLIC COMPOUNDS AND THEIR PREPARATION AND USE NOVO NORDISK AS (DK) 2001-09-12 EP disclosed
US-5773452-A ALZHEIMER'S DISEASE; COGNITION ACTIVATORS NOVO NORDISK ALS (DK) 1998-06-30 US disclosed
US-5753683-A SCHIZOPHRENIA NOVO NORDISK A/S (DK) 1998-05-19 US disclosed
US-5750541-A 3-(1,2,5-THIA OR OXADIAZOL-3-YL)-1,2,5,6-PYRIDINE DERIVATIVES; SCHIZOPHRENIFORM DISEASES; SIDE EFFECT REDUCTION NOVO NORDISK A/S (DK) 1998-05-12 US disclosed
US-5744489-A ADMINISTERING CERTAIN 1,2,5-THIADIAZOLE AND 1,2,5-OXADIAZOLE COMPOUNDS GREENWOOD BEVERLEY (US) 1998-04-28 US disclosed
US-5741788-A TREATING DISEASES IN CENTRAL NERVOUS SYSTEM CAUSED BY MALFUNCTIONING OF MUSCARINIC CHOLINERGIC SYSTEM ESPECIALLY ALZHEIMER'S DISEASE NOVO NORDISK A/S (DK) 1998-04-21 US disclosed
EP-0793665-A1 HETEROCYCLIC COMPOUNDS AND THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 1997-09-10 EP disclosed
EP-0788357-A1 A METHOD OF TREATING URINARY BLADDER DYSFUNCTIONS NOVO NORDISK A/S (DK) 1997-08-13 EP disclosed
US-5591755-A Pyridinyl thiadiazolyl compounds for treating glaucoma NOVO NORDISK A/S (DK) 1997-01-07 US disclosed
WO-1996016065-A1 HETEROCYCLIC COMPOUNDS AND THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 1996-05-30 WO disclosed
WO-1996014066-A1 A METHOD OF TREATING URINARY BLADDER DYSFUNCTIONS NOVO NORDISK A/S (DK) 1996-05-17 WO disclosed
EP-0687265-A1 HETEROCYCLIC COMPOUNDS AND THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 1995-12-20 EP disclosed
EP-0544714-B1 HETEROCYCLIC COMPOUNDS AND THEIR PREPARATION AND USE NOVO NORDISK AS (DK) 1995-11-22 EP disclosed
WO-1995017185-A1 A METHOD OF TREATING GASTROINTESTINAL MOTILITY DISORDERS NOVO NORDISK A/S (DK) 1995-06-29 WO disclosed
WO-1995005174-A1 ANTIPSYCHOTIC METHOD NOVO NORDISK A/S (DK) 1995-02-23 WO disclosed
WO-1994020495-A1 HETEROCYCLIC COMPOUNDS AND THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 1994-09-15 WO disclosed
US-5328923-A Compounds contain tetrahydropyridine ring and thiadiazole ring, Alzheimer*s disease, glaucoma, pain relief NOVO NORDISK A/S (DK) 1994-07-12 US disclosed
EP-0544714-A1 HETEROCYCLIC COMPOUNDS AND THEIR PREPARATION AND USE. NOVO NORDISK AS (DK) 1993-06-09 EP disclosed
WO-1992003431-A1 HETEROCYCLIC COMPOUNDS AND THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 1992-03-05 WO disclosed