SCHEMBL13325699

SCHEMBL13325699

CCOc1cccc2nccn12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK8 P49336 2/20 0.46
ROCK1 Q13464 2/20 0.46
CHEK1 O14757 1/20 0.46
MAP4K4 O95819 1/20 0.46
CSF1R P07333 1/20 0.46
PRKACA P17612 1/20 0.46
KDR P35968 1/20 0.46
MAP2K1 Q02750 1/20 0.46
ACVR1 Q04771 1/20 0.46
MAP4K2 Q12851 1/20 0.46
DYRK1A Q13627 1/20 0.46
AURKB Q96GD4 1/20 0.46
DYRK1B Q9Y463 1/20 0.46
FLT1 P17948 1/20 0.45
CDK9 P50750 1/20 0.45
LIMK1 P53667 1/20 0.45
CLK4 Q9HAZ1 1/20 0.45
ADORA3 P0DMS8 1/20 0.41
GRIN1 Q05586 1/20 0.36
GRIN2A Q12879 1/20 0.36

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
SCHEMBL15060275 0.86 CDK8 (0.44) CDK8ROCK1CHEK1MAP4K4CSF1R
SCHEMBL11537174 0.81 CDK8 (0.49) CDK8ROCK1CHEK1MAP4K4CSF1R
Hydrochloric Acid SCHEMBL11540203 0.80 CDK8 (0.47) CDK8ROCK1CHEK1MAP4K4CSF1R
SCHEMBL9002060 0.79 ROCK1 (0.44) CDK8ROCK1CHEK1MAP4K4CSF1R
Hydrochloric Acid SCHEMBL9002197 0.78 ROCK1 (0.42) CDK8ROCK1CHEK1MAP4K4CSF1R
SCHEMBL11536544 0.78 CDK8 (0.50) CDK8ROCK1CHEK1MAP4K4CSF1R
SCHEMBL9002040 0.78 CDK8 (0.40) CDK8ROCK1CHEK1MAP4K4CSF1R
SCHEMBL26328073 0.77 CDK8 (0.45) CDK8ROCK1CHEK1MAP4K4CSF1R
Hydrochloric Acid SCHEMBL9002407 0.77 CDK8 (0.41) CDK8ROCK1CHEK1MAP4K4CSF1R
SCHEMBL9002063 0.77 CDK8 (0.41) CDK8ROCK1CHEK1MAP4K4CSF1R

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-7714319-B2 Organic thin film transistor IDEMITSU KOSAN CO., LTD. (JP) 2010-05-11 US disclosed
US-20070120111-A1 Organic thin film transistor IDEMITSU KOSAN CO., LTD. (JP) 2007-05-31 US disclosed