SCHEMBL7006799

SCHEMBL7006799

NC(=O)OCC1CCCc2[nH]cnc21

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
AOC3 Q16853 3/20 0.37
PARP15 Q460N3 4/20 0.31
PARP10 Q53GL7 4/20 0.31
PARP2 Q9UGN5 2/20 0.31
RAB9A P51151 1/20 0.31
ALDH1A1 P00352 2/20 0.31
POLB P06746 1/20 0.31
LMNA P02545 1/20 0.30

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
SCHEMBL6846884 0.82 RAB9A (0.33) AOC3RAB9AALDH1A1POLBLMNA
SCHEMBL6847091 0.81 AOC3 (0.42) AOC3ALDH1A1POLB
SCHEMBL6850977 0.78 PDE3B (0.37) AOC3RAB9AALDH1A1POLB
SCHEMBL6849755 0.77 ALDH1A1 (0.40) AOC3RAB9AALDH1A1
SCHEMBL6955858 0.75 HRH3 (0.47) PARP15PARP10PARP2RAB9A
SCHEMBL6846885 0.75 RAB9A (0.36) RAB9AALDH1A1POLBLMNA
SCHEMBL6851075 0.74 SIRT1 (0.40) RAB9ALMNA
SCHEMBL6963222 0.73 METAP2 (0.44) RAB9AALDH1A1POLB
SCHEMBL6967672 0.71 L3MBTL1 (0.43) AOC3RAB9ALMNA
SCHEMBL28007449 0.71 NPC1 (0.40) RAB9AALDH1A1LMNA

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-1268484-A1 CONDENSED IMIDAZOLES AS HISTAMINE H3 RECEPTOR LIGANDS NOVO NORDISK A/S (DK) 2003-01-02 EP disclosed
WO-2001068652-A1 CONDENSED IMIDAZOLES AS HISTAMINE H3 RECEPTOR LIGANDS NOVO NORDISK A/S (DK) 2001-09-20 WO disclosed