SCHEMBL25735869

SCHEMBL25735869

Cc1cc([C@H](C)Nc2ccccc2)c2oc(N3CCCCC3)cc(=O)c2c1

nearest known ligand 0.85

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PIK3CA P42336 18/20 0.85
▸ PIK3CB P42338 4/20 0.85
▸ PRKDC P78527 2/20 0.85
▸ PIK3CD O00329 2/20 0.85
▸ PIK3CG P48736 2/20 0.85
▸ MTOR P42345 1/20 0.59
▸ PIK3C3 Q8NEB9 1/20 0.59

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
SCHEMBL23896256 1.00 PIK3CA (0.85) PIK3CAPIK3CBPRKDCPIK3CDPIK3CG
SCHEMBL23896257 1.00 PIK3CA (0.85) PIK3CAPIK3CBPRKDCPIK3CDPIK3CG
SCHEMBL23895633 0.92 PIK3CA (0.81) PIK3CAPIK3CBPRKDCPIK3CDPIK3CG
SCHEMBL21099894 0.92 PIK3CA (1.00) PIK3CAPIK3CBPRKDCPIK3CDPIK3CG
SCHEMBL25736875 0.92 PIK3CA (1.00) PIK3CAPIK3CBPRKDCPIK3CDPIK3CG
SCHEMBL23896128 0.91 PIK3CA (0.80) PIK3CAPIK3CBPRKDCPIK3CDPIK3CG
SCHEMBL23896129 0.91 PIK3CA (0.80) PIK3CAPIK3CBPRKDCPIK3CDPIK3CG
SCHEMBL23895795 0.90 PIK3CA (0.79) PIK3CAPIK3CBPRKDCPIK3CDPIK3CG
SCHEMBL30081835 0.90 PIK3CA (0.79) PIK3CAPIK3CBPRKDCPIK3CDPIK3CG
SCHEMBL23887081 0.90 PIK3CA (0.79) PIK3CAPIK3CBPRKDCPIK3CDPIK3CG

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-20240024490-A1 BIFUNCTIONAL MOLECULES FOR SELECTIVE MODIFICATION OF TARGET SUBSTRATES THE BROAD INSTITUTE, INC. 2024-01-25 — — US disclosed
US-20230192904-A1 BIFUNCTIONAL CHIMERIC MOLECULES FOR LABELING OF KINASES WITH TARGET BINDING MOIETIES AND METHODS OF USE THEREOF THE BROAD INSTITUTE, INC. 2023-06-22 — — 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 (2 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-20240024490-A1 BIFUNCTIONAL MOLECULES FOR SELECTIVE MODIFICATION OF TARGET SUBSTRATES COASY, JMJD7, PTMS PIK3CA 3409/4885PIK3CB 2319/4885PRKDC 796/4885
US-20230192904-A1 BIFUNCTIONAL CHIMERIC MOLECULES FOR LABELING OF KINASES WITH TARGET BINDING MOIETIES AND METHODS OF USE THEREOF ERBB2, ACP1, TK1 PIK3CA 377/4885PIK3CB 256/4885PRKDC 182/4885

“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.

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