SCHEMBL10837575

SCHEMBL10837575

O=C1CCc2cc(/C=C/CCN3CCOCC3)ccc2N1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TBXAS1 P24557 2/20 0.47
▸ PDE3B Q13370 2/20 0.47
▸ PDE3A Q14432 2/20 0.47
▸ SIGMAR1 Q99720 2/20 0.39
▸ HTR1A P08908 5/20 0.39
▸ SLC6A4 P31645 4/20 0.39
▸ DRD2 P14416 4/20 0.39
▸ HTR2A P28223 4/20 0.39
▸ DRD4 P21917 3/20 0.39
▸ HTR7 P34969 3/20 0.39
▸ DRD3 P35462 3/20 0.39
▸ HTR2C P28335 2/20 0.39
▸ CRBN Q96SW2 2/20 0.39
▸ PSEN1 P49768 2/20 0.38
▸ PSEN2 P49810 2/20 0.38
▸ APH1B Q8WW43 2/20 0.38
▸ NCSTN Q92542 2/20 0.38
▸ APH1A Q96BI3 2/20 0.38
▸ PSENEN Q9NZ42 2/20 0.38
▸ SLC6A2 P23975 2/20 0.38

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
SCHEMBL10837579 1.00 TBXAS1 (0.47) TBXAS1PDE3BPDE3ASIGMAR1HTR1A
SCHEMBL10836021 0.85 DRD2 (0.54) TBXAS1PDE3BPDE3ASIGMAR1HTR1A
SCHEMBL10836018 0.85 DRD2 (0.54) TBXAS1PDE3BPDE3ASIGMAR1HTR1A
SCHEMBL10838471 0.84 DRD2 (0.46) TBXAS1PDE3BPDE3AHTR1ASLC6A4
SCHEMBL10838477 0.84 DRD2 (0.46) TBXAS1PDE3BPDE3AHTR1ASLC6A4
SCHEMBL10836092 0.81 DRD2 (0.44) TBXAS1PDE3BPDE3AHTR1ASLC6A4
SCHEMBL10836091 0.81 DRD2 (0.44) TBXAS1PDE3BPDE3AHTR1ASLC6A4
SCHEMBL10837572 0.81 DRD2 (0.56) PDE3AHTR1ASLC6A4DRD2HTR2A
SCHEMBL10837576 0.81 DRD2 (0.56) PDE3AHTR1ASLC6A4DRD2HTR2A
SCHEMBL10838221 0.80 SLC6A4 (0.48) TBXAS1PDE3BPDE3AHTR1ASLC6A4

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
Send feedback