SCHEMBL10838043

SCHEMBL10838043

O=C1CCc2c(cccc2C(=O)CN2CCN(c3ccccc3)CC2)N1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ SCN1A P35498 1/20 0.47
▸ SCN5A Q14524 1/20 0.47
▸ SCN9A Q15858 1/20 0.47
▸ MAPT P10636 5/20 0.46
▸ ALDH1A1 P00352 3/20 0.46
▸ POLB P06746 2/20 0.45
▸ KDM4E B2RXH2 1/20 0.44
▸ DRD2 P14416 4/20 0.44
▸ MEN1 O00255 2/20 0.44
▸ KMT2A Q03164 2/20 0.44
▸ RECQL P46063 1/20 0.44
▸ DRD4 P21917 2/20 0.43
▸ DRD3 P35462 2/20 0.43
▸ APP P05067 1/20 0.42

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
SCHEMBL10835787 0.89 HTR1A (0.48) SCN1ASCN5ASCN9AALDH1A1DRD2
SCHEMBL11290166 0.78 HTR1A (0.52) KDM4EDRD2DRD4DRD3
SCHEMBL10836233 0.75 HTR1A (0.56) SCN1ASCN5ASCN9AMAPTDRD2
SCHEMBL10836259 0.75 HTR1A (0.53) SCN1ASCN5ASCN9ADRD2DRD4
SCHEMBL10836177 0.75 S1PR1 (0.44) DRD2DRD4DRD3
SCHEMBL10836497 0.75 DRD2 (0.60) DRD2
SCHEMBL10836380 0.75 DRD2 (0.46) SCN1ASCN5ASCN9ADRD2
Water SCHEMBL10836253 0.74 S1PR1 (0.43) DRD2DRD4DRD3
Hydrochloric Acid SCHEMBL10837925 0.74 S1PR1 (0.43) DRD2DRD4DRD3
SCHEMBL10837230 0.74 KDM4E (0.52) SCN1ASCN5ASCN9AKDM4EDRD2

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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