SCHEMBL30359504

SCHEMBL30359504

c1ccc(-c2ccc3ncc4nnc(C5CCOCC5)n4c3c2)cc1

nearest known ligand 0.82

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PRKDC P78527 20/20 0.82
PIK3CB P42338 17/20 0.82
ATR Q13535 16/20 0.82
ATRIP Q8WXE1 16/20 0.82
ATM Q13315 10/20 0.82
MTOR P42345 6/20 0.74
SERPINA2 P20848 2/20 0.52

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
SCHEMBL21541782 1.00 PRKDC (0.82) PRKDCPIK3CBATRATRIPATM
SCHEMBL21541902 0.86 PRKDC (0.66) PRKDCPIK3CBATRATRIPATM
SCHEMBL30359525 0.84 PRKDC (0.68) PRKDCPIK3CBATRATRIPATM
SCHEMBL30359511 0.84 PRKDC (0.68) PRKDCPIK3CBATRATRIPATM
SCHEMBL21541790 0.84 PRKDC (0.68) PRKDCPIK3CBATRATRIPATM
SCHEMBL21541818 0.84 PRKDC (0.68) PRKDCPIK3CBATRATRIPATM
SCHEMBL20374457 0.83 PRKDC (0.67) PRKDCPIK3CBATRATRIPATM
SCHEMBL21541725 0.82 PRKDC (0.69) PRKDCPIK3CBATRATRIPATM
SCHEMBL21541737 0.82 PRKDC (0.66) PRKDCPIK3CBATRATRIPATM
SCHEMBL30359510 0.82 PRKDC (0.69) PRKDCPIK3CBATRATRIPATM

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
CN-110167941-B Substituted fused heteroaryl compounds as kinase inhibitors and uses thereof 上海瑛派药业有限公司 2023-04-04 CN disclosed