SCHEMBL26598838

SCHEMBL26598838

CN1CCN(C2=c3ccccc3=Nc3ccc(Cl)cc3N2O)CC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DRD2 P14416 14/20 0.43
▸ HRH4 Q9H3N8 6/20 0.43
▸ DRD4 P21917 5/20 0.43
▸ HRH1 P35367 4/20 0.42
▸ HRH2 P25021 3/20 0.42
▸ HRH3 Q9Y5N1 2/20 0.42
▸ DRD1 P21728 11/20 0.42
▸ CHRM1 P11229 4/20 0.41
▸ DRD3 P35462 4/20 0.41
▸ CHRM2 P08172 3/20 0.41
▸ HTR1A P08908 3/20 0.41
▸ ADRA2A P08913 3/20 0.41
▸ ADRA2B P18089 3/20 0.41
▸ ADRA2C P18825 3/20 0.41
▸ CHRM3 P20309 3/20 0.41
▸ SLC6A2 P23975 3/20 0.41
▸ HTR2A P28223 3/20 0.41
▸ HTR2C P28335 3/20 0.41
▸ SLC6A4 P31645 3/20 0.41
▸ ADRA1A P35348 3/20 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
SCHEMBL11929726 0.88 DRD2 (0.47) DRD2HRH4DRD4HRH1HRH2
SCHEMBL21887284 0.86 DRD2 (0.43) DRD2HRH4DRD4HRH1HRH2
SCHEMBL11925296 0.84 DRD2 (0.42) DRD2HRH4DRD4HRH1HRH2
SCHEMBL24199399 0.78 DRD2 (0.41) DRD2HRH4DRD4DRD1ADRA2A
SCHEMBL23125443 0.77 DRD2 (0.41) DRD2HRH4DRD4DRD1LMNA
SCHEMBL23125441 0.77 DRD1 (0.40) DRD2HRH4DRD4DRD1LMNA
SCHEMBL15047809 0.77 DRD2 (0.40) DRD2HRH4DRD4DRD1LMNA
SCHEMBL24199398 0.76 DRD2 (0.40) DRD2HRH4DRD4DRD1LMNA
SCHEMBL20751555 0.76 DRD2 (0.40) DRD2HRH4DRD4DRD1LMNA
SCHEMBL20751562 0.75 DRD2 (0.38) DRD2HRH4DRD4DRD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118807068-A Novel targets for the treatment or diagnosis of mood disorders or stress disorders and uses thereof 浙江大学 2024-10-22 — — CN disclosed
CN-117500561-A Novel targets for the treatment or diagnosis of mood disorders or stress disorders and uses thereof 浙江大学 2024-02-02 — — CN disclosed
WO-2023202682-A1 NOVEL TARGET FOR TREATING OR DIAGNOSING EMOTIONAL DISORDERS OR STRESS DISORDERS, AND APPLICATION THEREOF 浙江大学 2023-10-26 — — WO disclosed
CN-114668765-B Application of clozapine N-oxide in preparation of medicine for preventing and treating nitrogen anesthesia 南通大学 2023-06-02 — — CN disclosed
CN-114668765-A Application of clozapine N-oxide in preparation of medicine for preventing and treating nitrogen anesthesia 南通大学 2022-06-28 — — CN disclosed
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