SCHEMBL11258774

SCHEMBL11258774

CCOC(=O)Cc1cccc2c(-c3ccc(N)cc3)nccc12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.41
JAK2 O60674 1/20 0.39
JAK3 P52333 1/20 0.39
GAA P10253 2/20 0.39
ALDH1A1 P00352 5/20 0.39
MAPT P10636 4/20 0.39
KDM4E B2RXH2 4/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
LMNA P02545 1/20 0.39
AHR P35869 1/20 0.39
HPGD P15428 3/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
TBXAS1 P24557 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
HTT P42858 2/20 0.38
POLB P06746 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
PRMT5 O14744 1/20 0.38
PPIB P23284 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
SCHEMBL11251095 0.91 ALDH1A1 (0.47) PKMGAAALDH1A1MAPTKDM4E
SCHEMBL11253180 0.89 GAA (0.49) PKMGAAALDH1A1MAPTKDM4E
SCHEMBL11257859 0.86 JAK2 (0.41) PKMJAK2JAK3GAAALDH1A1
SCHEMBL11252609 0.86 PKM (0.39) PKMGAAALDH1A1MAPTKDM4E
SCHEMBL11499255 0.86 GAA (0.46) PKMGAAALDH1A1MAPTKDM4E
SCHEMBL11248521 0.84 RAB9A (0.46) GAAALDH1A1MAPTKDM4EMEN1
SCHEMBL11254420 0.77 PKM (0.45) PKMALDH1A1MAPTKDM4EKMT2A
SCHEMBL11253776 0.76 ROS1 (0.41) GAAALDH1A1MAPTKDM4EMEN1
SCHEMBL11266566 0.76 KDR (0.40) ALDH1A1MAPTKDM4EKMT2ATDP1
SCHEMBL11246786 0.75 LMNA (0.48) GAAALDH1A1MAPTKDM4EMEN1

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
US-4337256-A ANTIINFLAMMATORY AGENTS; ANTIAGGLOMERANTS; ENZYME INHIBITORS; ANTIULCER AGENTS TEIKOKU HORMONE MANUFACTURING CO., LTD. (JP) 1982-06-29 US disclosed
EP-0013411-A1 Isoquinoline derivatives, process for their preparation and pharmaceutical compositions containing them TEIKOKU HORMONE MFG. CO., LTD. (JP) 1980-07-23 EP disclosed