SCHEMBL24270595

SCHEMBL24270595

COc1ccc(Nc2cc3c(cn2)n(C)c(=O)n3-c2ccc(C(C)(C)C#N)cc2)c(C)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ PRKDC P78527 19/20 1.00
▸ PIK3CA P42336 18/20 1.00
▸ MTOR P42345 8/20 0.78
▸ PIK3CD O00329 2/20 0.59
▸ PIK3CB P42338 2/20 0.59
▸ PIK3CG P48736 2/20 0.59
▸ ATM Q13315 2/20 0.59
▸ CSF1R P07333 1/20 0.59
▸ MAPK9 P45984 1/20 0.59
▸ MAPK10 P53779 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
SCHEMBL29492845 1.00 PRKDC (1.00) PRKDCPIK3CAMTORPIK3CDPIK3CB
SCHEMBL24270869 0.88 PRKDC (1.00) PRKDCPIK3CAMTORPIK3CDPIK3CB
SCHEMBL29492733 0.88 PRKDC (1.00) PRKDCPIK3CAMTORPIK3CDPIK3CB
SCHEMBL29492843 0.88 PIK3CA (0.78) PRKDCPIK3CAMTORPIK3CDPIK3CB
SCHEMBL24270530 0.88 PIK3CA (0.78) PRKDCPIK3CAMTORPIK3CDPIK3CB
SCHEMBL24270482 0.85 PRKDC (1.00) PRKDCPIK3CAMTORPIK3CDPIK3CB
SCHEMBL29492675 0.85 PRKDC (1.00) PRKDCPIK3CAMTORPIK3CDPIK3CB
SCHEMBL29492798 0.84 PRKDC (1.00) PRKDCPIK3CAMTORPIK3CDPIK3CB
SCHEMBL24270652 0.84 PRKDC (1.00) PRKDCPIK3CAMTORPIK3CDPIK3CB
SCHEMBL24270622 0.81 PRKDC (0.89) PRKDCPIK3CAMTORPIK3CDPIK3CB

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-20230365559-A1 NOVEL AMINOPYRIDINES AND THEIR USE IN TREATING CANCER AUCKLAND UNISERVICES LIMITED (NZ) 2023-11-16 — — US disclosed
WO-2022064430-A1 NOVEL AMINOPYRIDINES AND THEIR USE IN TREATING CANCER AUCKLAND UNISERVICES LIMITED (NZ) 2022-03-31 — — 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-20230365559-A1 NOVEL AMINOPYRIDINES AND THEIR USE IN TREATING CANCER DCK, DTYMK, TYMP PRKDC 64/4885PIK3CA 302/4885MTOR 571/4885

“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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