SCHEMBL4519531

SCHEMBL4519531

N#Cc1ccc2[nH]nc(C(=O)Nc3ccncc3)c2c1

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ LRRK2 Q5S007 14/20 0.57
▸ CCNA2 P20248 1/20 0.50
▸ CDK2 P24941 1/20 0.50
▸ FLT3 P36888 1/20 0.50
▸ CCNA1 P78396 1/20 0.50
▸ ITK Q08881 3/20 0.49
▸ DYRK1A Q13627 2/20 0.49
▸ CLK2 P49760 1/20 0.49
▸ CLK3 P49761 1/20 0.49
▸ AURKA O14965 1/20 0.48
▸ WNT1 P04628 1/20 0.48

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
Hydrochloric Acid SCHEMBL4523142 0.99 LRRK2 (0.56) LRRK2CCNA2CDK2FLT3CCNA1
SCHEMBL4520668 0.82 FLT3 (0.55) CCNA2CDK2FLT3CCNA1DYRK1A
SCHEMBL4531693 0.82 FLT3 (0.55) CCNA2CDK2FLT3CCNA1DYRK1A
SCHEMBL4522712 0.81 PRKAA1 (0.54) CCNA2CDK2FLT3CCNA1DYRK1A
SCHEMBL14804593 0.80 DYRK1A (0.70) LRRK2DYRK1ACLK2CLK3WNT1
SCHEMBL4521580 0.78 DYRK1A (0.52) CCNA2CDK2FLT3CCNA1DYRK1A
SCHEMBL30026349 0.78 FLT3 (0.81) CCNA2CDK2FLT3CCNA1
SCHEMBL20894463 0.77 PRKAG1 (0.51) LRRK2ITK
SCHEMBL14804594 0.77 DYRK1A (0.64) LRRK2DYRK1ACLK2CLK3WNT1
SCHEMBL4513067 0.77 CSNK2A1 (0.63) CCNA2CDK2FLT3CCNA1DYRK1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7482342-B2 Indazolecarboxamide derivatives, preparation and use thereof as CDK1, CDK2 and CDK4 inhibitors SANOFI-AVENTIS (FR) 2009-01-27 — — US disclosed
US-20060004000-A1 Indazolecarboxamide derivatives, preparation and use thereof as CDK1, CDK2 and CDK4 inhibitors SANOFI-AVENTIS (FR) 2006-01-05 — — US disclosed
EP-1549620-A1 INDAZOLECARBOXAMIDE DERIVATIVES, PREPARATION AND USE THEREOF AS CDK1, CDK2 AND CDK4 INHIBITORS Sanofi-Aventis (FR) 2005-07-06 — — EP disclosed
WO-2004031158-A1 INDAZOLECARBOXAMIDE DERIVATIVES, PREPARATION AND USE THEREOF AS CDK1, CDK2 AND CDK4 INHIBITORS SANOFI-AVENTIS (FR) 2004-04-15 — — WO 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-20060004000-A1 Indazolecarboxamide derivatives, preparation and use thereof as CDK1, CDK2 and CDK4 inhibitors CDK2, CDK1, CDK4 LRRK2 1183/4885CCNA2 10/4885CDK2 1/4885

“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.

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