SCHEMBL21101173

SCHEMBL21101173

COC(=O)c1ccc(CN2CCC(CNC3CC3)C2)cc1

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.56
▸ KDM1A O60341 2/20 0.54
▸ KMT2A Q03164 2/20 0.51
▸ MEN1 O00255 1/20 0.51
▸ CHRM4 P08173 1/20 0.51
▸ CXCR3 P49682 1/20 0.49
▸ L3MBTL1 Q9Y468 1/20 0.49
▸ LMNA P02545 1/20 0.48
▸ CHKA P35790 1/20 0.48
▸ CHRM2 P08172 1/20 0.48
▸ CHRM1 P11229 1/20 0.48
▸ CHRM3 P20309 1/20 0.48

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
SCHEMBL21100969 1.00 KDM4E (0.56) KDM4EKDM1AKMT2AMEN1CHRM4
SCHEMBL21101175 0.88 KDM1A (0.58) KDM1AKMT2AMEN1
SCHEMBL16130141 0.85 KDM4E (0.64) KDM4EKDM1AKMT2AMEN1CHRM4
SCHEMBL20257081 0.82 KDM4E (0.65) KDM4EKDM1AKMT2AMEN1CHRM4
SCHEMBL16309046 0.82 KDM1A (0.73) KDM1A
SCHEMBL15425027 0.82 KDM1A (0.73) KDM1A
SCHEMBL15423787 0.82 KDM1A (0.73) KDM1A
SCHEMBL15423786 0.82 KDM1A (0.73) KDM1A
SCHEMBL16309047 0.82 KDM1A (0.73) KDM1A
SCHEMBL15425028 0.82 KDM1A (0.73) KDM1A

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
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