SCHEMBL8961341

SCHEMBL8961341

O=C(CN(CCCN1C(=O)c2ccccc2C1=O)Cc1ccccc1)OCc1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MAOB P27338 12/20 0.62
ACHE P22303 8/20 0.59
BCHE P06276 3/20 0.59
ALDH1A1 P00352 1/20 0.47

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
SCHEMBL8131752 0.82 MAOB (0.83) MAOBACHEBCHE
SCHEMBL9824940 0.82 MAOB (0.83) MAOBACHEBCHE
SCHEMBL22778380 0.80 ALDH1A1 (0.49) ALDH1A1
SCHEMBL6789754 0.79 ALDH1A1 (0.57) ACHEALDH1A1
SCHEMBL8398570 0.78 MAOB (0.84) MAOBACHEBCHE
SCHEMBL7571319 0.78 ALDH1A1 (0.59) ALDH1A1
SCHEMBL10725421 0.78 L3MBTL1 (0.59) ACHEALDH1A1
SCHEMBL19631329 0.78 HDAC3 (0.47) MAOBACHEBCHEALDH1A1
SCHEMBL21084263 0.77 MAOB (1.00) MAOBACHEBCHE
SCHEMBL20780399 0.77 ALDH1A1 (0.51) ACHEALDH1A1

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
EP-0693081-A1 CYCLIC COMPOUNDS AND COMPOSITIONS WHICH INHIBIT BONE RESORPTION Novartis AG (CH) 1996-01-24 EP disclosed
WO-1994024153-A1 CYCLIC COMPOUNDS AND COMPOSITIONS WHICH INHIBIT BONE RESORPTION CIBA-GEIGY AG (CH) 1994-10-27 WO disclosed