SCHEMBL10461476

SCHEMBL10461476

O=C1CCc2cc(CCCn3ccnc3)ccc2N1

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ TBXAS1 P24557 6/20 0.55
▸ PDE3B Q13370 4/20 0.55
▸ PDE3A Q14432 4/20 0.55
▸ CRBN Q96SW2 2/20 0.55
▸ SLC6A4 P31645 2/20 0.53
▸ HTR1A P08908 2/20 0.53
▸ DRD2 P14416 2/20 0.53
▸ HTR2A P28223 2/20 0.53
▸ DRD4 P21917 1/20 0.53
▸ HTR2C P28335 1/20 0.53
▸ HTR7 P34969 1/20 0.53
▸ DRD3 P35462 1/20 0.53
▸ CYP19A1 P11511 1/20 0.49
▸ HMOX1 P09601 1/20 0.45
▸ SLC6A2 P23975 1/20 0.45
▸ SLC6A3 Q01959 1/20 0.45
▸ MAOA P21397 1/20 0.44
▸ MAOB P27338 1/20 0.44

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 SCHEMBL10464252 0.99 TBXAS1 (0.54) TBXAS1PDE3BPDE3ACRBNSLC6A4
SCHEMBL10464344 0.97 HTR1A (0.57) TBXAS1PDE3BPDE3ACRBNSLC6A4
Acetic Acid SCHEMBL10463268 0.94 TBXAS1 (0.52) TBXAS1PDE3BPDE3ACRBNSLC6A4
SCHEMBL10463554 0.93 TBXAS1 (0.57) TBXAS1PDE3BPDE3ACRBNSLC6A4
SCHEMBL27653364 0.82 HTR1A (0.47) TBXAS1PDE3BPDE3ACRBNSLC6A4
SCHEMBL10464711 0.81 TBXAS1 (0.50) TBXAS1PDE3BPDE3ACRBNSLC6A4
SCHEMBL10464750 0.80 TBXAS1 (0.63) TBXAS1PDE3BPDE3ACRBN
SCHEMBL10464749 0.80 TBXAS1 (0.63) TBXAS1PDE3BPDE3ACRBN
SCHEMBL10463777 0.79 PDE3B (0.52) TBXAS1PDE3BPDE3ACRBNSLC6A4
SCHEMBL10463789 0.77 HTR1A (0.53) TBXAS1PDE3BPDE3ACRBNHTR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4921862-A Carbostyril derivatives as combined thromboxane synthetase and cyclic-amp phosphodiesterase inhibitors SYNTEX (U.S.A.) INC. (US) 1990-05-01 — — US disclosed
US-4792561-A ANTICOAGULANTS, CARDIOVASCULAR DISORDERS SYNTEX (U.S.A.) INC. (US) 1988-12-20 — — US disclosed
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