SCHEMBL4514663

SCHEMBL4514663

N#Cc1cccc(NC(=O)c2n[nH]c3ccc(-c4cncc5ccccc45)cc23)c1.O=C(NCc1cccnc1)c1n[nH]c2ccc(-c3cncc4ccccc34)cc12

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ DYRK1A Q13627 14/20 0.52
▸ WNT1 P04628 13/20 0.52
▸ ITK Q08881 3/20 0.49
▸ AURKA O14965 1/20 0.48
▸ ABL1 P00519 1/20 0.47
▸ CSF1R P07333 1/20 0.47
▸ IGF1R P08069 1/20 0.47
▸ PDGFRB P09619 1/20 0.47
▸ KIT P10721 1/20 0.47
▸ FGFR1 P11362 1/20 0.47
▸ FLT1 P17948 1/20 0.47
▸ FLT4 P35916 1/20 0.47
▸ KDR P35968 1/20 0.47
▸ TEK Q02763 1/20 0.47
▸ CLK2 P49760 6/20 0.46
▸ CLK3 P49761 6/20 0.46
▸ ATR Q13535 1/20 0.46

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
SCHEMBL6221471 0.90 DYRK1A (0.62) DYRK1AWNT1ITKAURKAABL1
SCHEMBL4523358 0.88 DYRK1A (0.58) DYRK1AWNT1ABL1CSF1RIGF1R
SCHEMBL82407 0.88 DYRK1A (0.66) DYRK1AWNT1CLK2CLK3
SCHEMBL953365 0.79 DYRK1A (0.61) DYRK1AWNT1ABL1CSF1RIGF1R
Hydrochloric Acid SCHEMBL955121 0.79 DYRK1A (0.60) DYRK1AWNT1ABL1CSF1RIGF1R
SCHEMBL82655 0.77 DYRK1A (0.70) DYRK1AWNT1ABL1CSF1RIGF1R
SCHEMBL6219544 0.74 DYRK1A (0.72) DYRK1AWNT1CLK2CLK3
SCHEMBL4523182 0.73 DYRK1A (0.67) DYRK1AWNT1CLK2CLK3
SCHEMBL14785564 0.73 DYRK1A (0.69) DYRK1AWNT1CLK2CLK3
SCHEMBL82445 0.72 LRRK2 (0.56) DYRK1AWNT1ITKAURKACLK2

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-20060004000-A1 Indazolecarboxamide derivatives, preparation and use thereof as CDK1, CDK2 and CDK4 inhibitors SANOFI-AVENTIS (FR) 2006-01-05 — — US claimed
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

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 DYRK1A 425/4885WNT1 364/4885ITK 4137/4885

“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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