SCHEMBL991266

SCHEMBL991266

CCOc1nccnc1C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.45
ALOX15 P16050 3/20 0.43
L3MBTL1 Q9Y468 3/20 0.43
ALDH1A1 P00352 5/20 0.42
GAA P10253 1/20 0.42
MAPT P10636 5/20 0.41
NPSR1 Q6W5P4 2/20 0.40
KMT2A Q03164 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
HPGD P15428 1/20 0.39
SLC13A5 Q86YT5 2/20 0.38
TSHR P16473 2/20 0.38
CYP3A4 P08684 1/20 0.38
BLM P54132 1/20 0.38
AGER Q15109 1/20 0.38
PRKAB2 O43741 1/20 0.38
PRKAG1 P54619 1/20 0.38
PRKAA2 P54646 1/20 0.38
PRKAA1 Q13131 1/20 0.38
PRKAG3 Q9UGI9 1/20 0.38

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
SCHEMBL27805414 0.82 PARP10 (0.43) L3MBTL1ALDH1A1NPSR1KMT2ASMN1; SMN2
SCHEMBL11732040 0.81 MAPT (0.49) KDM4EALOX15L3MBTL1ALDH1A1MAPT
SCHEMBL8516191 0.80 KDM4E (0.38) KDM4EALOX15L3MBTL1ALDH1A1MAPT
SCHEMBL1111686 0.79 MAPT (0.47) KDM4EALOX15L3MBTL1ALDH1A1MAPT
SCHEMBL30592770 0.79 MAPT (0.47) KDM4EALOX15L3MBTL1ALDH1A1MAPT
Hydrochloric Acid SCHEMBL17674838 0.78 MAPT (0.46) KDM4EALOX15L3MBTL1ALDH1A1MAPT
SCHEMBL7598688 0.75 HPGD (0.52) KDM4EL3MBTL1ALDH1A1GAANPSR1
SCHEMBL14398367 0.74 KDM4E (0.60) KDM4EALOX15L3MBTL1ALDH1A1MAPT
SCHEMBL8539977 0.74 MAPT (0.41) KDM4EALOX15L3MBTL1ALDH1A1MAPT
SCHEMBL7547389 0.74 KDM4E (0.41) KDM4EALDH1A1MAPTKMT2ASMN1; SMN2

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
EP-2456774-A1 FUSED AMINODIHYDRO-OXAZINE DERIVATIVES Eisai R&D Management Co., Ltd. (JP) 2012-05-30 EP disclosed
WO-2011009898-A1 FUSED AMINODIHYDRO-OXAZINE DERIVATIVES EISAI R&D MANAGEMENT CO., LTD (JP) 2011-01-27 WO disclosed