SCHEMBL28255285

SCHEMBL28255285

O=C(O)N(C1CCNCC1)C1CC1c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 9/20 0.43
MAOB P27338 5/20 0.43
SLC6A4 P31645 2/20 0.43
CISD1 Q9NZ45 1/20 0.43
SLC6A2 P23975 1/20 0.43
HTR1B P28222 1/20 0.43
HTR2A P28223 1/20 0.43
SLC18A3 Q16572 1/20 0.42
SIGMAR1 Q99720 1/20 0.42
MAOA P21397 4/20 0.42
MAPT P10636 1/20 0.39
PKM P14618 1/20 0.39

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
SCHEMBL23856027 1.00 KDM1A (0.43) KDM1AMAOBSLC6A4CISD1SLC6A2
SCHEMBL18817699 1.00 KDM1A (0.43) KDM1AMAOBSLC6A4CISD1SLC6A2
SCHEMBL19609797 0.85 SLC6A4 (0.42) KDM1AMAOBSLC6A4CISD1SLC6A2
SCHEMBL18817746 0.82 KDM1A (0.41) KDM1AMAOBSLC6A4CISD1SLC6A2
SCHEMBL21775670 0.82 KDM1A (0.41) KDM1AMAOBSLC6A4CISD1SLC6A2
SCHEMBL18817744 0.82 KDM1A (0.41) KDM1AMAOBSLC6A4CISD1SLC6A2
SCHEMBL23867768 0.82 KDM1A (0.41) KDM1AMAOBSLC6A4CISD1SLC6A2
SCHEMBL21784349 0.82 KDM1A (0.41) KDM1AMAOBSLC6A4CISD1SLC6A2
SCHEMBL19091464 0.82 KDM1A (0.41) KDM1AMAOBSLC6A4CISD1SLC6A2
SCHEMBL22279799 0.78 KDM1A (0.47) KDM1AMAOBSLC6A4CISD1SLC6A2

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-108884029-A L SD1 inhibitors 米拉蒂医疗股份有限公司 2018-11-23 CN disclosed