SCHEMBL20125807

SCHEMBL20125807

O=C(NCc1ccccc1)c1n[nH]c2ccc(-c3cncc(CN4CCC4)c3)cc12

nearest known ligand 0.95

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 20/20 0.95
WNT1 P04628 12/20 0.95
CLK2 P49760 2/20 0.77
CLK3 P49761 2/20 0.77

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
SCHEMBL17095659 0.97 DYRK1A (1.00) DYRK1AWNT1CLK2CLK3
SCHEMBL14792058 0.91 DYRK1A (0.87) DYRK1AWNT1CLK2CLK3
SCHEMBL14792120 0.88 DYRK1A (0.81) DYRK1AWNT1CLK2CLK3
SCHEMBL17095865 0.88 DYRK1A (1.00) DYRK1AWNT1CLK2CLK3
SCHEMBL17096266 0.87 DYRK1A (1.00) DYRK1AWNT1CLK2CLK3
SCHEMBL14792099 0.86 DYRK1A (0.84) DYRK1AWNT1CLK2CLK3
SCHEMBL17096860 0.86 DYRK1A (0.85) DYRK1AWNT1CLK2CLK3
SCHEMBL14792079 0.86 DYRK1A (0.85) DYRK1AWNT1CLK2CLK3
SCHEMBL14792821 0.85 DYRK1A (0.74) DYRK1AWNT1CLK2CLK3
SCHEMBL14804385 0.85 DYRK1A (0.73) DYRK1AWNT1CLK2CLK3

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-20180127377-A1 5-SUBSTITUTED INDAZOLE-3-CARBOXAMIDES AND PREPARATION AND USE THEREOF VICKERS-SPLICE CO-INVESTMENT LLC (KY) 2018-05-10 US disclosed
US-20180127377-A1 5-SUBSTITUTED INDAZOLE-3-CARBOXAMIDES AND PREPARATION AND USE THEREOF VICKERS-SPLICE CO-INVESTMENT LLC (KY) 2018-05-10 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-20180127377-A1 5-SUBSTITUTED INDAZOLE-3-CARBOXAMIDES AND PREPARATION AND USE THEREOF DYRK1A, WNT3, WNT1 DYRK1A 1/4885WNT1 3/4885CLK2 86/4885

“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.