SCHEMBL6703979

SCHEMBL6703979

Cn1ncc2c(Nc3ncc(C#N)s3)nccc21

nearest known ligand 0.46

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KDR P35968 19/20 0.46
TP53 P04637 1/20 0.36

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
SCHEMBL6703634 0.77 RXFP1 (0.45) KDR
SCHEMBL7229531 0.74 KDR (0.57) KDR
SCHEMBL6704628 0.73 KDR (0.49) KDR
SCHEMBL6705038 0.72 KDR (0.48) KDR
SCHEMBL6701891 0.71 KDR (0.45) KDR
SCHEMBL7237669 0.71 KDR (0.59) KDR
SCHEMBL3439331 0.70 KDM4E (0.35) TP53
SCHEMBL31575349 0.70 KDM4E (0.35) TP53
SCHEMBL5741877 0.69 KDR (0.61) KDR
SCHEMBL25786936 0.67 CYP1A2 (0.35) TP53

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-20040235867-A1 Tyrosine kinase inhibitors BILODEAU MARK T (US) 2004-11-25 US claimed
WO-2003009852-A1 TYROSINE KINASE INHIBITORS MERCK & CO., INC. (US) 2003-02-06 WO claimed
US-20040235867-A1 Tyrosine kinase inhibitors BILODEAU MARK T (US) 2004-11-25 US disclosed
WO-2003009852-A1 TYROSINE KINASE INHIBITORS MERCK & CO., INC. (US) 2003-02-06 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-20040235867-A1 Tyrosine kinase inhibitors ERBB2, TYRO3, TIE1 KDR 5/4885TP53 579/4885

“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.