SCHEMBL10837065

SCHEMBL10837065

O=C1CCc2cc(C(=O)CCN3CCN(c4ccccc4F)CC3)ccc2N1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTR1A P08908 6/20 0.61
▸ HTR2A P28223 4/20 0.61
▸ HTR7 P34969 2/20 0.61
▸ DRD3 P35462 2/20 0.61
▸ DRD4 P21917 1/20 0.61
▸ ALDH1A1 P00352 5/20 0.60
▸ KDM4E B2RXH2 3/20 0.60
▸ LMNA P02545 2/20 0.60
▸ TSHR P16473 2/20 0.60
▸ MPI P34949 1/20 0.60
▸ KMT2A Q03164 1/20 0.60
▸ SMN1; SMN2 Q16637 2/20 0.57
▸ HTT P42858 1/20 0.57
▸ DRD2 P14416 4/20 0.57
▸ L3MBTL1 Q9Y468 1/20 0.57
▸ CRBN Q96SW2 2/20 0.52
▸ MAPT P10636 2/20 0.51
▸ PKM P14618 1/20 0.51
▸ HPGD P15428 1/20 0.51
▸ NSD2 O96028 1/20 0.50

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
SCHEMBL10837493 0.85 HTR1A (0.65) HTR1AHTR2AHTR7DRD3DRD4
Hydrochloric Acid SCHEMBL10838441 0.85 HTR1A (0.65) HTR1AHTR2AHTR7DRD3DRD4
Hydrochloric Acid SCHEMBL10837752 0.83 DRD2 (0.57) HTR1AHTR2AHTR7DRD3DRD4
Hydrochloric Acid SCHEMBL10837864 0.83 DRD2 (0.61) HTR1AHTR2AHTR7DRD3DRD4
SCHEMBL10837652 0.83 SMN1; SMN2 (0.54) HTR1AHTR2AHTR7DRD3DRD4
Hydrochloric Acid SCHEMBL10838709 0.82 HTR1A (0.69) HTR1AHTR2AHTR7DRD3DRD4
Hydrochloric Acid SCHEMBL10836483 0.82 HTR1A (0.68) HTR1AHTR2AHTR7DRD3DRD4
SCHEMBL10837311 0.81 HTR1A (0.60) HTR1AHTR2AHTR7DRD3DRD4
SCHEMBL10837319 0.80 DRD3 (0.74) HTR1AHTR2AHTR7DRD3DRD4
Hydrochloric Acid SCHEMBL10837678 0.79 HTR1A (0.58) HTR1AHTR2AHTR7DRD3DRD4

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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