SCHEMBL364302

SCHEMBL364302

CCCCNC(=O)c1c2ccc(OC)cc2n2ccccc12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 0.48
MAPT P10636 6/20 0.48
ALDH1A1 P00352 6/20 0.48
MEN1 O00255 5/20 0.48
KDM4E B2RXH2 5/20 0.48
PABPC1 P11940 2/20 0.48
SAE1 Q9UBE0 2/20 0.48
UBA2 Q9UBT2 2/20 0.48
APAF1 O14727 1/20 0.48
G6PD P11413 1/20 0.48
CACNA1B Q00975 1/20 0.48
APBA1 Q02410 1/20 0.48
LMNA P02545 4/20 0.47
HTT P42858 3/20 0.47
MAPK1 P28482 1/20 0.47
CASP3 P42574 1/20 0.47
NCOA1 Q15788 1/20 0.47
SENP6 Q9GZR1 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
L3MBTL1 Q9Y468 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
SCHEMBL366361 0.83 S1PR3 (0.52) KMT2AMAPTALDH1A1MEN1KDM4E
SCHEMBL364303 0.82 KMT2A (0.46) KMT2AMAPTALDH1A1MEN1KDM4E
SCHEMBL5240666 0.81 MAPT (0.48) KMT2AMAPTALDH1A1MEN1KDM4E
SCHEMBL365703 0.80 KMT2A (0.50) KMT2AMAPTKDM4EMTNR1AMTNR1B
SCHEMBL365564 0.80 KMT2A (0.56) KMT2AMAPTALDH1A1MEN1KDM4E
SCHEMBL365013 0.79 KDM4E (0.58) KMT2AMAPTALDH1A1MEN1KDM4E
SCHEMBL364968 0.78 KDM4E (0.70) KMT2AMAPTALDH1A1MEN1KDM4E
SCHEMBL364593 0.78 KMT2A (0.56) KMT2AMAPTALDH1A1MEN1KDM4E
SCHEMBL364407 0.76 ALDH1A1 (0.47) KMT2AMAPTALDH1A1MEN1KDM4E
SCHEMBL364206 0.76 KMT2A (0.54) KMT2AMAPTALDH1A1MEN1KDM4E

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