SCHEMBL10838437

SCHEMBL10838437

CCOc1ccccc1N1CCN(CCC(=O)c2cccc3c2CCC(=O)N3)CC1

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ DRD2 P14416 10/20 0.55
▸ SCN1A P35498 1/20 0.52
▸ SCN5A Q14524 1/20 0.52
▸ SCN9A Q15858 1/20 0.52
▸ HTR1A P08908 6/20 0.52
▸ HTR7 P34969 4/20 0.52
▸ HTR2A P28223 2/20 0.50
▸ HTR6 P50406 2/20 0.50
▸ DRD4 P21917 5/20 0.47
▸ DRD3 P35462 5/20 0.47
▸ OPRM1 P35372 1/20 0.46
▸ OPRL1 P41146 1/20 0.46

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
Hydrochloric Acid SCHEMBL10835643 0.99 DRD2 (0.54) DRD2SCN1ASCN5ASCN9AHTR1A
SCHEMBL10836259 0.85 HTR1A (0.53) DRD2SCN1ASCN5ASCN9AHTR1A
SCHEMBL10836233 0.85 HTR1A (0.56) DRD2SCN1ASCN5ASCN9AHTR1A
SCHEMBL10569129 0.83 DRD2 (0.66) DRD2HTR1AHTR7HTR2AHTR6
Hydrochloric Acid SCHEMBL10837514 0.82 DRD2 (0.51) DRD2SCN1ASCN5ASCN9AHTR1A
SCHEMBL10835787 0.81 HTR1A (0.48) DRD2SCN1ASCN5ASCN9AHTR1A
Hydrochloric Acid SCHEMBL10837864 0.81 DRD2 (0.61) DRD2HTR1AHTR7HTR2ADRD4
SCHEMBL10836177 0.76 S1PR1 (0.44) DRD2HTR1AHTR2ADRD4DRD3
Hydrochloric Acid SCHEMBL10836173 0.76 DRD4 (0.66) DRD2HTR1AHTR7HTR2ADRD4
SCHEMBL6352115 0.76 HTR1A (0.78) DRD2HTR1AHTR7DRD4DRD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4619932-A CENTRAL NERVOUS SYSTEM CONTROLLERS; ANTI-SCHIZOPHRENIA AGENTS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1986-10-28 — — US disclosed
US-4567187-A CENTRAL NERVOUS SYSTEM OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1986-01-28 — — US disclosed
US-4460593-A Carbostyril derivatives, and central nervous system controlling agents containing the carbostyril derivatives OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1984-07-17 — — US disclosed
US-4455422-A ANTIHISTAMINES, CNS CONTROLLERS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1984-06-19 — — US disclosed
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