SCHEMBL23508290

SCHEMBL23508290

Fc1cccc2[nH]c(CNc3nc(N4CCOCC4)nc4c(CC(F)(F)F)cnn34)nc12

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CSNK1E P49674 20/20 0.48
CSNK1D P48730 15/20 0.48
CDK13 Q14004 2/20 0.44
CDK12 Q9NYV4 2/20 0.44
CDK4 P11802 1/20 0.44
CCND1 P24385 1/20 0.44
CDK6 Q00534 1/20 0.44

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
SCHEMBL23497590 0.90 CSNK1E (0.57) CSNK1ECSNK1DCDK13CDK12CDK4
SCHEMBL23497480 0.89 CSNK1E (0.42) CSNK1ECSNK1DCDK13CDK12CDK4
SCHEMBL23508480 0.89 CSNK1E (0.51) CSNK1ECSNK1DCDK13CDK12CDK4
SCHEMBL23508274 0.88 CSNK1E (0.50) CSNK1ECSNK1DCDK13CDK12CDK4
SCHEMBL23508362 0.87 CSNK1E (0.50) CSNK1ECSNK1DCDK13CDK12CDK4
SCHEMBL29788806 0.87 CSNK1E (0.50) CSNK1ECSNK1DCDK13CDK12CDK4
SCHEMBL23497608 0.87 CSNK1E (0.50) CSNK1ECSNK1DCDK13CDK12CDK4
SCHEMBL23508376 0.85 CSNK1E (0.48) CSNK1ECSNK1DCDK13CDK12CDK4
SCHEMBL23508676 0.84 CSNK1E (0.44) CSNK1ECSNK1DCDK13CDK12CDK4
SCHEMBL23508434 0.82 CSNK1E (0.45) CSNK1ECSNK1DCDK13CDK12CDK4

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-20230117034-A1 PYRAZOLOTRIAZINES BAYER AKTIENGESELLSCHAFT (DE) 2023-04-20 US disclosed
WO-2021116178-A1 PYRAZOLOTRIAZINES BAYER AKTIENGESELLSCHAFT (DE) 2021-06-17 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-20230117034-A1 PYRAZOLOTRIAZINES BRCA1, TPX2, CCND2 CSNK1E 1596/4885CSNK1D 963/4885CDK13 302/4885

“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.