SCHEMBL10347652

SCHEMBL10347652

CCCN(CCC)CCc1ccc(OC)c2c1=NC(=O)N=2

nearest known ligand 0.42

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 2/20 0.39
EBP Q15125 1/20 0.39
TMEM97 Q5BJF2 1/20 0.39

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
SCHEMBL10347509 0.83 HTR1A (0.41) SIGMAR1
SCHEMBL10347239 0.80 DRD2 (0.53)
Bromide SCHEMBL10347450 0.79 DRD2 (0.52)
Hydrochloric Acid SCHEMBL10870298 0.75 DRD2 (0.48)
SCHEMBL10347485 0.73 DRD2 (0.48)
SCHEMBL9689118 0.72 DRD2 (0.40) SIGMAR1EBPTMEM97
SCHEMBL9688926 0.72 HTR1A (0.46) SIGMAR1EBPTMEM97
SCHEMBL9689630 0.70 KDM4E (0.40) SIGMAR1EBPTMEM97
SCHEMBL10959824 0.70 AOC3 (0.48) SIGMAR1EBPTMEM97
SCHEMBL10753475 0.70 AOC3 (0.51) SIGMAR1EBPTMEM97

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-0175525-B1 7-[2-(Dialkylamino)ethyl]-4-hydroxy-1,3-benzimidazol-2-ones SMITHKLINE BEECHAM CORPORATION (US) 1990-05-23 EP disclosed
EP-0175525-A1 7-[2-(Dialkylamino)ethyl]-4-hydroxy-1,3-benzimidazol-2-ones SMITHKLINE BEECHAM CORPORATION (US) 1986-03-26 EP disclosed
US-4554287-A Antihypertensive 7-[2-(dialkylamino)ethyl]-4-hydroxy-1,3-benzimidazol-2-ones SMITHKLINE BECKMAN CORPORATION (US) 1985-11-19 US disclosed