SCHEMBL7003392

SCHEMBL7003392

Cc1c(OCc2ccccc2)ccc2c1cc1c(=O)n(C)ccn12

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 3/20 0.48
MAPT P10636 2/20 0.43
TDP1 Q9NUW8 2/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
MAPK1 P28482 1/20 0.43
P2RY12 Q9H244 1/20 0.42
MAOB P27338 4/20 0.41
BRD4 O60885 5/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
ACHE P22303 1/20 0.39
MEN1 O00255 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
KMT2A Q03164 1/20 0.38
MTNR1A P48039 1/20 0.38
MTNR1B P49286 1/20 0.38
HTR6 P50406 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
SCHEMBL7009955 0.76 NPC1 (0.56) MAPK14L3MBTL1MAOBMEN1NPC1
SCHEMBL7003203 0.74 MTNR1A (0.43) MAPK14MAPTMAPK1MEN1NPC1
SCHEMBL7006729 0.74 ALOX5 (0.48) MAPK14L3MBTL1MAOBACHEMEN1
SCHEMBL11970494 0.70 MAPK14 (0.52) MAPK14MAPTTDP1L3MBTL1MAPK1
SCHEMBL24556370 0.69 MAPK14 (0.49) MAPK14MAPTTDP1L3MBTL1MAPK1
SCHEMBL6797552 0.69 KDM4E (0.49) MAPTTDP1L3MBTL1MAPK1CYP2C9
SCHEMBL9007487 0.68 MAPT (0.80) MAPK14MAPTTDP1L3MBTL1MAPK1
SCHEMBL15957895 0.67 TP53 (0.55) MAPK14MAPTTDP1L3MBTL1MAPK1
SCHEMBL22990508 0.66 MAPK14 (0.68) MAPK14MAPTTDP1L3MBTL1MAPK1
SCHEMBL4384374 0.66 MAPK14 (0.68) MAPK14MAPTTDP1L3MBTL1MAPK1

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
EP-1200439-B1 1,2-DIHYDRO-1-OXO-PARAZINO(1,2-A) INDOLE DERIVATIVES NOVUSPHARMA SPA (IT) 2003-06-25 EP disclosed