SCHEMBL15123762

SCHEMBL15123762

CC(O)C(=O)N1CCC(c2nnc3cnc4ccc(-c5cnc(N)c(C(F)(F)F)c5)cc4n23)CC1

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PRKDC P78527 18/20 0.48
PIK3CB P42338 15/20 0.48
ATR Q13535 15/20 0.47
ATRIP Q8WXE1 15/20 0.47
ATM Q13315 9/20 0.46
MTOR P42345 6/20 0.45
SERPINA2 P20848 3/20 0.44
PIK3CA P42336 2/20 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
SCHEMBL796977 1.00 PRKDC (0.48) PRKDCPIK3CBATRATRIPATM
SCHEMBL15131813 0.89 PRKDC (0.54) PRKDCPIK3CBATRATRIPATM
SCHEMBL15131819 0.85 PRKDC (0.55) PRKDCPIK3CBATRATRIPATM
SCHEMBL15131817 0.81 PRKDC (0.45) PRKDCPIK3CBATRATRIPATM
SCHEMBL15131816 0.81 PRKDC (0.45) PRKDCPIK3CBATRATRIPATM
SCHEMBL797021 0.79 PRKDC (0.46) PRKDCPIK3CBATRATRIPATM
SCHEMBL797022 0.79 PRKDC (0.46) PRKDCPIK3CBATRATRIPATM
SCHEMBL15133613 0.78 PIK3CA (0.47) PRKDCPIK3CBATRATRIPPIK3CA
SCHEMBL807829 0.78 PRKDC (0.38) PRKDCPIK3CBATRATRIPATM
SCHEMBL10070584 0.76 GRIN2B (0.47) PRKDCPIK3CBATRATRIPMTOR

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-9181264-B2 Fused heteroaryls and their uses HUTCHISON MEDIPHARMA LIMITED (CN) 2015-11-10 US disclosed
US-20130190307-A1 FUSED HETEROARYLS AND THEIR USES HUTCHISON MEDIPHARMA LIMITED (CN) 2013-07-25 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-20130190307-A1 FUSED HETEROARYLS AND THEIR USES FARS2, TIAL1, DHFR PRKDC 3135/4885PIK3CB 1750/4885ATR 3548/4885

“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.