SCHEMBL9609441

SCHEMBL9609441

Cc1cc(Nc2ncc3c(=O)n4c(nc3n2)c2ccccc2n4C2CC2)ccc1N1CCN(C)CC1

nearest known ligand 0.52

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TTK P33981 1/20 0.52
TNK2 Q07912 11/20 0.50
EGFR P00533 8/20 0.49

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
SCHEMBL8510401 0.90 TNK2 (0.51) TTKTNK2EGFR
SCHEMBL8510826 0.87 TNK2 (0.49) TTKTNK2EGFR
SCHEMBL8514280 0.87 EGFR (0.49) TTKTNK2EGFR
SCHEMBL216531 0.87 TNK2 (0.48) TTKTNK2EGFR
SCHEMBL187898 0.87 TNK2 (0.48) TTKTNK2EGFR
SCHEMBL8510005 0.87 TNK2 (0.48) TTKTNK2EGFR
SCHEMBL8509340 0.86 WEE1 (0.50) TTKTNK2EGFR
SCHEMBL8510333 0.85 TNK2 (0.49) TTKTNK2EGFR
SCHEMBL8513556 0.85 TNK2 (0.46) TTKTNK2EGFR
SCHEMBL215533 0.85 TNK2 (0.48) TTKTNK2EGFR

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-8288396-B2 Pyrimidopyrimidoindazole derivative MSDKK (JP) 2012-10-16 US disclosed
US-8288396-B2 Pyrimidopyrimidoindazole derivative MSDKK (JP) 2012-10-16 US disclosed
US-20120134955-A1 PYRIMIDOPYRIMIDOINDAZOLE DERIVATIVE MSD K.K. (JP) 2012-05-31 US disclosed
US-20120134955-A1 PYRIMIDOPYRIMIDOINDAZOLE DERIVATIVE MSD K.K. (JP) 2012-05-31 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-20120134955-A1 PYRIMIDOPYRIMIDOINDAZOLE DERIVATIVE WEE1, WEE2, DCK TTK 27/4885TNK2 170/4885EGFR 425/4885

“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.