SCHEMBL4530465

SCHEMBL4530465

O=Cc1c[nH]c2nccc(Cl)c12.O=Cc1c[nH]c2nccc(Cl)c12

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 5/20 0.53
KMT2A Q03164 1/20 0.51
CDK9 P50750 3/20 0.47
CDK2 P24941 2/20 0.47
CDK5 Q00535 2/20 0.47
AXL P30530 2/20 0.47
PRKCI P41743 2/20 0.47
AURKB Q96GD4 2/20 0.47
DYRK1B Q9Y463 2/20 0.47
ROCK2 O75116 2/20 0.47
ROCK1 Q13464 2/20 0.47
CDC42BPA Q5VT25 2/20 0.47
CDC7 O00311 1/20 0.47
PLK4 O00444 1/20 0.47
CHEK1 O14757 1/20 0.47
MAPK13 O15264 1/20 0.47
PDPK1 O15530 1/20 0.47
DAPK3 O43293 1/20 0.47
DYRK3 O43781 1/20 0.47
PRKD3 O94806 1/20 0.47

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
SCHEMBL857522 1.00 LRRK2 (0.53) LRRK2KMT2ACDK9CDK2CDK5
SCHEMBL29958532 0.86 KMT2A (0.47) LRRK2KMT2ACDK9CDK2CDK5
SCHEMBL29957196 0.84 KMT2A (0.56) LRRK2KMT2ACDK9CDK2CDK5
SCHEMBL27815684 0.83 LRRK2 (0.53) LRRK2KMT2ACDK9CDK2CDK5
SCHEMBL20757818 0.80 KMT2A (0.49) LRRK2KMT2ACDK9CDK2CDK5
SCHEMBL24758304 0.80 LRRK2 (0.48) LRRK2CDK9CDK2CDK5AXL
SCHEMBL29952688 0.79 KMT2A (0.51) LRRK2KMT2ACDK9CDK2CDK5
SCHEMBL17843962 0.79 KMT2A (0.51) LRRK2KMT2ACDK9CDK5AURKB
SCHEMBL29958099 0.79 KMT2A (0.51) LRRK2KMT2ACDK9CDK2CDK5
SCHEMBL672053 0.79 CYP2A6 (0.51) LRRK2KMT2ACDK9AXLPRKCI

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-8314121-B2 Imidazolone derivatives, preparation thereof as drugs, pharmaceutical compositions, and use thereof as protein kinase inhibitors, in particular CDC7 SANOFI (FR) 2012-11-20 US disclosed
US-20090253679-A1 NEW IMIDAZOLONE DERIVATIVES, PREPARATION THEREOF AS DRUGS, PHARMACEUTICAL COMPOSITIONS, AND USE THEREOF AS PROTEIN KINASE INHIBITORS, IN PARTICULAR CDC7 SANOFI-AVENTIS (FR) 2009-10-08 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-20090253679-A1 NEW IMIDAZOLONE DERIVATIVES, PREPARATION THEREOF AS DRUGS, PHARMACEUTICAL COMPOSITIONS, AND USE THEREOF AS PROTEIN KINASE INHIBITORS, IN PARTICULAR CDC7 CDC7, CDK7, CDK17 LRRK2 825/4885KMT2A 3256/4885CDK9 170/4885

“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.