SCHEMBL5448707

SCHEMBL5448707

C=C(C)CSNC(=O)Nc1ccc2ncc(-c3ccc(OC)cc3)nc2n1

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 19/20 0.52
PIK3CA P42336 13/20 0.52
MAPK8 P45983 11/20 0.52
MAPK9 P45984 11/20 0.52
MAPK10 P53779 11/20 0.52
ABL1 P00519 1/20 0.46
PIM1 P11309 1/20 0.46
AURKB Q96GD4 1/20 0.46
MAPK14 Q16539 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
SCHEMBL5453196 0.81 PIK3CA (0.78) MAPK1PIK3CAMAPK8MAPK9MAPK10
SCHEMBL4679525 0.78 MAPK1 (0.60) MAPK1PIK3CAMAPK8MAPK9MAPK10
SCHEMBL5443639 0.76 MAPK1 (0.47) MAPK1PIK3CAMAPK8MAPK9MAPK10
SCHEMBL12970824 0.75 MAPK1 (0.80) MAPK1PIK3CAMAPK8MAPK9MAPK10
SCHEMBL5623238 0.74 PIK3CA (0.70) MAPK1PIK3CAMAPK8MAPK9MAPK10
SCHEMBL3638708 0.74 PIK3CA (0.72) MAPK1PIK3CAMAPK8MAPK9MAPK10
SCHEMBL4739232 0.74 MAPK1 (0.52) MAPK1PIK3CAMAPK8MAPK9MAPK10
SCHEMBL5622765 0.73 PIK3CA (0.74) MAPK1PIK3CAMAPK8MAPK9MAPK10
SCHEMBL14506574 0.72 MAPK1 (0.75) MAPK1PIK3CAMAPK8MAPK9MAPK10
SCHEMBL5622692 0.72 MAPK1 (0.64) MAPK1PIK3CAMAPK8MAPK9MAPK10

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070123494-A1 PYRIDOPYRAZINE DERIVATIVES AND THEIR USE ZENTARIS GMBH (DE) 2007-05-31 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-20070123494-A1 PYRIDOPYRAZINE DERIVATIVES AND THEIR USE PLPBP, PDXK, MAP4K2 MAPK1 58/4885PIK3CA 866/4885MAPK8 116/4885

“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.