SCHEMBL30497097

SCHEMBL30497097

CC(C)(C)OP(=O)(OCn1cc(-c2ccn(Cc3cccc(C(F)(F)F)c3F)c(=O)c2)c2cc(N3CCOCC3)cnc21)OC(C)(C)C

nearest known ligand 0.63

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 15/20 0.63
▸ PIK3CD O00329 5/20 0.37
▸ PIK3CB P42338 5/20 0.37
▸ PIK3CA P42336 4/20 0.37
▸ PIK3CG P48736 4/20 0.37
▸ MTOR P42345 1/20 0.33

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
SCHEMBL30497094 1.00 MAPK1 (0.63) MAPK1PIK3CDPIK3CBPIK3CAPIK3CG
SCHEMBL21557678 1.00 MAPK1 (0.63) MAPK1PIK3CDPIK3CBPIK3CAPIK3CG
SCHEMBL20503904 0.95 MAPK1 (0.68) MAPK1PIK3CDPIK3CBPIK3CAPIK3CG
SCHEMBL23667743 0.93 MAPK1 (0.65) MAPK1PIK3CDPIK3CBPIK3CAPIK3CG
SCHEMBL22403223 0.92 MAPK1 (0.62) MAPK1PIK3CDPIK3CBPIK3CAPIK3CG
SCHEMBL21558009 0.92 MAPK1 (0.53) MAPK1
SCHEMBL30497088 0.92 MAPK1 (0.52) MAPK1
SCHEMBL21558028 0.92 MAPK1 (0.52) MAPK1
SCHEMBL30497098 0.92 MAPK1 (0.53) MAPK1
SCHEMBL30497090 0.92 MAPK1 (0.52) MAPK1

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-11708364-B2 Azaindole derivatives and their use as ERK kinase inhibitors AGV DISCOVERY (FR) 2023-07-25 — — 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-11708364-B2 Azaindole derivatives and their use as ERK kinase inhibitors MAPKAPK2, MAPK1, MAPK3 MAPK1 2/4885PIK3CD 224/4885PIK3CB 326/4885

“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.

Send feedback