SCHEMBL8224486

SCHEMBL8224486

COc1ccc(CNc2cc(C(C)C)ccn2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CLK4 Q9HAZ1 7/20 0.54
DYRK1A Q13627 4/20 0.51
CLK1 P49759 1/20 0.50
NPC1 O15118 3/20 0.47
RAB9A P51151 3/20 0.47
MAPT P10636 1/20 0.47
KMT2A Q03164 2/20 0.46
MEN1 O00255 1/20 0.46
POLB P06746 1/20 0.46
CCNB2 O95067 1/20 0.45
CDK1 P06493 1/20 0.45
CCNB1 P14635 1/20 0.45
CCNB3 Q8WWL7 1/20 0.45
MAPK13 O15264 1/20 0.45
MAPK12 P53778 1/20 0.45
MAPK11 Q15759 1/20 0.45
MAPK14 Q16539 1/20 0.45
ALDH1A1 P00352 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
NOS2 P35228 1/20 0.44

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
SCHEMBL8229603 0.83 KDM4E (0.54) NPC1RAB9AKMT2AMEN1POLB
SCHEMBL20045031 0.82 NOS2 (0.49) CLK4DYRK1ANPC1RAB9AMAPT
SCHEMBL8229631 0.82 NOS2 (0.65) CLK4NPC1RAB9AKMT2AMEN1
SCHEMBL8422251 0.81 MEN1 (0.68) CLK4DYRK1ACLK1NPC1RAB9A
SCHEMBL28131061 0.80 CLK4 (0.57) CLK4DYRK1ACLK1NPC1RAB9A
SCHEMBL17602044 0.79 NPC1 (0.59) CLK4DYRK1ACLK1NPC1RAB9A
SCHEMBL3159168 0.79 CLK4 (0.56) CLK4DYRK1ACLK1NPC1RAB9A
SCHEMBL439371 0.78 CLK4 (0.66) CLK4DYRK1ACLK1NPC1RAB9A
SCHEMBL17393176 0.78 CLK4 (0.54) CLK4DYRK1ACLK1NPC1RAB9A
SCHEMBL3923979 0.77 CLK4 (0.53) CLK4DYRK1ACLK1NPC1RAB9A

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-20070142369-A1 Combination of an H3 antagonist/inverse agonist and an appetite suppressant SCHERING CORPORATION 2007-06-21 US disclosed
US-7220735-B2 Benzimidazolone histamine H3 antagonists SCHERING CORPORATION (US) 2007-05-22 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070142369-A1 Combination of an H3 antagonist/inverse agonist and an appetite suppressant CNR2, GPR119, GLP1R CLK4 2923/4885DYRK1A 1270/4885CLK1 2727/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.