SCHEMBL8564321

SCHEMBL8564321

N#Cc1cc2c([nH]c1=O)CCN(Cc1ccccc1)C2

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SLC6A5 Q9Y345 1/20 0.53
KDM4E B2RXH2 2/20 0.49
NPSR1 Q6W5P4 1/20 0.49
HSD11B1 P28845 1/20 0.48
ACHE P22303 4/20 0.48
AKR1B1 P15121 1/20 0.45
CLPP Q16740 2/20 0.45
ALDH1A1 P00352 1/20 0.45
GLA P06280 1/20 0.45
GAA P10253 1/20 0.45
MAPT P10636 1/20 0.45
HPGD P15428 1/20 0.45
KMT2A Q03164 1/20 0.45
ADORA1 P30542 1/20 0.44
GABRA1 P14867 1/20 0.43
GABRA2 P47869 1/20 0.43

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
SCHEMBL16264682 0.83 SLC6A5 (0.54) SLC6A5KDM4EACHEAKR1B1CLPP
SCHEMBL17984953 0.83 SLC6A5 (0.54) SLC6A5ACHEAKR1B1CLPPKMT2A
SCHEMBL8566026 0.80 SLC6A5 (0.54) SLC6A5KDM4EACHEAKR1B1CLPP
SCHEMBL9256480 0.80 HPGD (0.51) SLC6A5KDM4EACHEAKR1B1ALDH1A1
SCHEMBL8562303 0.80 SLC6A5 (0.51) SLC6A5KDM4EACHEAKR1B1CLPP
Hydrochloric Acid SCHEMBL4793706 0.79 HPGD (0.50) SLC6A5KDM4EACHEAKR1B1ALDH1A1
SCHEMBL31376614 0.78 MEN1 (0.50) SLC6A5ACHEAKR1B1ALDH1A1HPGD
SCHEMBL16264683 0.78 SLC6A5 (0.49) SLC6A5KDM4EACHEAKR1B1ALDH1A1
SCHEMBL31647682 0.77 HSD11B1 (0.54) SLC6A5KDM4EHSD11B1ACHECLPP
SCHEMBL8560032 0.76 SLC6A5 (0.47) SLC6A5ACHEAKR1B1KMT2AGABRA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5424433-A Benzodiazepine receptor agonist DAINIPPON PHARMACEUTICAL CO., LTD. (JP) 1995-06-13 US claimed
JP-9104684-A None JP disclosed
WO-2025134078-A1 ORGANIC COMPOUNDS AS MUSCARINIC M4 RECEPTOR POSITIVE ALLOSTERIC MODULATORS (M4 PAMS) SUVEN LIFE SCIENCES LIMITED (IN) 2025-06-26 WO disclosed
EP-0588500-B1 3-Oxadiazolyl-1,6-naphthyridine derivatives with affinity for benzodiazepine receptors DAINIPPON PHARMACEUTICAL CO (JP) 1998-11-04 EP disclosed
JP-H09104684-A 5,6,7,8-TETRAHYDRO-2(1H)-OXO-1,6-NAPHTHYRIDINE-3-CARBONITRILE DERIVATIVE AND ITS ACID ADDITION SALT DAINIPPON PHARMACEUT CO LTD 1997-04-22 JP disclosed
US-5424433-A Benzodiazepine receptor agonist DAINIPPON PHARMACEUTICAL CO., LTD. (JP) 1995-06-13 US disclosed
US-5424434-A Intramolecular cyclodehydration with a phosphorus(III) compound and a dialkyl azodicarboxylate in presence of a base to form a benzodiazepine receptor agonist, anxiolytic agent DAINIPPON PHARMACEUTICAL CO., LTD. (JP) 1995-06-13 US disclosed
US-5367078-A Benzodiazine receptor agonists DAINIPPON PHARMACEUTICAL CO., LTD. (JP) 1994-11-22 US disclosed
EP-0588500-A2 3-Oxadiazolyl-1,6-naphthyridine derivatives with affinity for benzodiazepine receptors DAINIPPON PHARMACEUTICAL CO., LTD. (JP) 1994-03-23 EP disclosed