SCHEMBL28815307

SCHEMBL28815307

CC(C)(C)C(=O)ONC1CC1c1ccc(OCc2ccccc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 18/20 0.56
MAOB P27338 16/20 0.56
MAOA P21397 15/20 0.56
PRKCA P17252 1/20 0.47
PRKCD Q05655 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
SCHEMBL27991097 0.89 KDM1A (0.54) KDM1AMAOBMAOA
SCHEMBL27891316 0.87 MAOB (0.59) KDM1AMAOBMAOA
SCHEMBL27991074 0.83 APP (0.46) KDM1AMAOBMAOA
SCHEMBL28801756 0.83 KDM1A (0.62) KDM1AMAOBMAOA
SCHEMBL27908354 0.80 KDM1A (0.41) KDM1AMAOBMAOA
SCHEMBL2755939 0.80 KDM1A (0.64) KDM1AMAOBMAOA
SCHEMBL15091475 0.80 KDM1A (0.64) KDM1AMAOBMAOA
SCHEMBL12972044 0.80 KDM1A (0.64) KDM1AMAOBMAOA
SCHEMBL18923952 0.80 KDM1A (0.64) KDM1AMAOBMAOA
SCHEMBL20724187 0.80 KDM1A (0.64) KDM1AMAOBMAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102639496-B Lysine specific demethylase-1 inhibitors and their use ORYZON GENOMICS, S.A. (ES) 2014-10-29 CN disclosed