SCHEMBL9655128

SCHEMBL9655128

Cc1ncc2c(-c3ccccc3)cccn12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.42
ALDH1A1 P00352 4/20 0.42
CHEK1 O14757 2/20 0.42
MAPT P10636 2/20 0.42
LIMK1 P53667 1/20 0.42
MAPK14 Q16539 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
RET P07949 1/20 0.41
MET P08581 1/20 0.41
LTK P29376 1/20 0.41
GRK5 P34947 1/20 0.41
CDK8 P49336 1/20 0.41
RPS6KA3 P51812 1/20 0.41
MST1R Q04912 1/20 0.41
TYRO3 Q06418 1/20 0.41
DYRK1A Q13627 1/20 0.41
LRRK2 Q5S007 1/20 0.41
CLK4 Q9HAZ1 1/20 0.41
ALK Q9UM73 1/20 0.41
DYRK1B Q9Y463 1/20 0.41

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
SCHEMBL9655135 0.88 QPCT (0.37) KDM4EALDH1A1MAPTTDP1NPC1
SCHEMBL9658073 0.81 MAPT (0.43) KDM4EALDH1A1MAPTTDP1NPC1
SCHEMBL11175719 0.78 BAZ2B (0.37) KDM4EALDH1A1MAPTTDP1NPC1
SCHEMBL25045782 0.73 KDM4E (0.38) KDM4EALDH1A1CHEK1MAPTLIMK1
SCHEMBL23104811 0.73 LCK (0.38) KDM4EALDH1A1CHEK1MAPTLIMK1
SCHEMBL9730543 0.72 RET (0.35) KDM4EALDH1A1CHEK1MAPTLIMK1
SCHEMBL24127754 0.70 SSTR4 (0.42) KDM4EALDH1A1MAPTRAB9AHPGD
SCHEMBL23707124 0.70 TP53 (0.39) KDM4EALDH1A1MAPTGLAGAA
SCHEMBL23132917 0.70 NR1I2 (0.33) KDM4EALDH1A1GLAGAAHPGD
SCHEMBL11177746 0.70 ATP4A (0.54) MAPTMAPK14TDP1MEN1KMT2A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5171858-A Preparation of certain 5,6-dihydro-8-phenyl-imidazo[1,5-a]pyridines SCHERING A.G. (DE) 1992-12-15 US disclosed
US-5171859-A Certain 2-aminomethyl-3-phenyl-pyridine intermediates for certain 8-phenyl-imidazo[1,5-a]pyridines SCHERING A.G. (DE) 1992-12-15 US disclosed
US-5026712-A Novel imidazo[1,5-a]pyridines, useful as cardiovascular and CNS agents SCHERING AG (DE) 1991-06-25 US disclosed