SCHEMBL21101344

SCHEMBL21101344

CNC1C[C@H]1c1ccc(NC(=O)c2ccccc2)cc1

nearest known ligand 0.68

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 12/20 0.68
MAOA P21397 10/20 0.68
MAOB P27338 10/20 0.68
RCOR1 Q9UKL0 3/20 0.68
KDM1B Q8NB78 1/20 0.68
NPC1 O15118 3/20 0.56
RAB9A P51151 3/20 0.56
KDM4E B2RXH2 1/20 0.56
MAPT P10636 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
PTPN1 P18031 1/20 0.53
CACNA1B Q00975 1/20 0.53
APBA1 Q02410 1/20 0.53
SIRT1 Q96EB6 1/20 0.51
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51

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
SCHEMBL31187352 0.86 KDM1A (0.51) KDM1AMAOAMAOBRCOR1KDM1B
SCHEMBL15789116 0.86 KDM1A (0.68) KDM1AMAOAMAOBRCOR1KDM1B
SCHEMBL15789119 0.86 KDM1A (0.68) KDM1AMAOAMAOBRCOR1KDM1B
SCHEMBL22335069 0.83 KDM1A (0.77) KDM1AMAOAMAOBRCOR1KDM1B
SCHEMBL15787819 0.83 KDM1A (0.77) KDM1AMAOAMAOBRCOR1KDM1B
SCHEMBL15789029 0.82 KDM1A (0.62) KDM1AMAOAMAOBRCOR1KDM1B
SCHEMBL14701059 0.82 KDM1A (0.62) KDM1AMAOAMAOBRCOR1KDM1B
SCHEMBL14701055 0.82 KDM1A (0.69) KDM1AMAOAMAOBRCOR1KDM1B
SCHEMBL15789154 0.82 KDM1A (0.69) KDM1AMAOAMAOBRCOR1KDM1B
SCHEMBL15789077 0.81 KDM1A (0.72) KDM1AMAOAMAOBRCOR1KDM1B

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
EP-2688568-B1 CYCLOPROPYLAMINES AS LSD1 INHIBITORS GLAXOSMITHKLINE IP NO 2 LTD (GB) 2019-06-19 EP disclosed