SCHEMBL9834879

SCHEMBL9834879

Cc1ccc(/C=C/C(=O)NCCCN2CCN(C(c3ccccc3)c3ccccc3)CC2)cn1

nearest known ligand 0.94

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 1/20 0.94
▸ DRD2 P14416 12/20 0.72
▸ DRD3 P35462 12/20 0.72
▸ SMN1; SMN2 Q16637 1/20 0.53

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
SCHEMBL9834884 1.00 ALOX5 (0.94) ALOX5DRD2DRD3SMN1; SMN2
Tagorizine SCHEMBL6008778 0.97 ALOX5 (1.00) ALOX5DRD2DRD3SMN1; SMN2
Tagorizine SCHEMBL6008781 0.97 ALOX5 (1.00) ALOX5DRD2DRD3SMN1; SMN2
Tagorizine SCHEMBL29359054 0.97 ALOX5 (1.00) ALOX5DRD2DRD3SMN1; SMN2
Tagorizine SCHEMBL139324 0.97 ALOX5 (1.00) ALOX5DRD2DRD3SMN1; SMN2
SCHEMBL10824600 0.87 DRD2 (0.94) ALOX5DRD2DRD3SMN1; SMN2
SCHEMBL10824599 0.87 DRD2 (0.94) ALOX5DRD2DRD3SMN1; SMN2
Hydrochloric Acid SCHEMBL10826444 0.86 DRD2 (0.92) ALOX5DRD2DRD3SMN1; SMN2
Hydrochloric Acid SCHEMBL10826443 0.86 DRD2 (0.92) ALOX5DRD2DRD3SMN1; SMN2
SCHEMBL9617895 0.86 ALOX5 (0.80) ALOX5DRD2DRD3SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0210782-B1 PYRIDINE COMPOUNDS, PROCESS FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME Dainippon Pharmaceutical Co., Ltd. (JP) 1991-04-17 — — EP disclosed
US-4778796-A ω-(3-pyridyl)alkenamide derivatives and anti-allergenic pharmaceutical compositions containing same DAINIPPON PHARMACEUTICAL CO., LTD. (JP) 1988-10-18 — — US disclosed
EP-0210782-A2 Pyridine compounds, process for the preparation thereof and pharmaceutical composition containing the same Dainippon Pharmaceutical Co., Ltd. (JP) 1987-02-04 — — EP disclosed
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