SCHEMBL366971

SCHEMBL366971

CCOC(=O)c1c2ccccc2n2cc(OCc3ccccc3)ccc12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.48
KDM4E B2RXH2 3/20 0.48
LMNA P02545 2/20 0.48
GAA P10253 1/20 0.48
PKM P14618 1/20 0.48
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
ALDH1A1 P00352 2/20 0.48
APAF1 O14727 1/20 0.48
G6PD P11413 1/20 0.48
PABPC1 P11940 1/20 0.48
CACNA1B Q00975 1/20 0.48
APBA1 Q02410 1/20 0.48
SAE1 Q9UBE0 1/20 0.48
UBA2 Q9UBT2 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.45
HSP90AA1 P07900 1/20 0.45
NR1H4 Q96RI1 1/20 0.45
GABRA1 P14867 1/20 0.44

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
SCHEMBL364784 0.93 KDM4E (0.47) MAPTKDM4ELMNAGAAPKM
SCHEMBL4477445 0.93 RXRA (0.50) MAPTKDM4ELMNAGAAPKM
SCHEMBL364674 0.91 KDM4E (0.48) MAPTKDM4ELMNAGAAPKM
SCHEMBL364182 0.91 MAOB (0.46) MAPTKDM4ELMNAGAAPKM
SCHEMBL364482 0.90 KDM4E (0.48) MAPTKDM4ELMNAGAAPKM
SCHEMBL366340 0.90 MAOB (0.49) MAPTKDM4EGAAMEN1KMT2A
SCHEMBL367034 0.89 ELANE (0.48) MAPTKDM4EMEN1KMT2AALDH1A1
SCHEMBL365408 0.88 ALDH1A1 (0.46) MAPTKDM4ELMNAGAAPKM
SCHEMBL366987 0.87 KDM4E (0.53) MAPTKDM4ELMNAGAAMEN1
SCHEMBL366360 0.86 FFAR1 (0.47) MAPTKDM4ELMNAGAAPKM

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
WO-2012007007-A1 INHIBITORS OF HDME EPITHERAPEUTICS APS (DK) 2012-01-19 WO claimed
WO-2012007007-A1 INHIBITORS OF HDME EPITHERAPEUTICS APS (DK) 2012-01-19 WO disclosed