SCHEMBL27124075

SCHEMBL27124075

CC1CN(c2nnc3cnc4ccc(-c5ccc(OCCCN(C)C)c(Cl)c5)cc4n23)C[C@H](C)N1C

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ATM Q13315 16/20 0.49
▸ PRKDC P78527 7/20 0.49
▸ HRH4 Q9H3N8 3/20 0.37
▸ ATR Q13535 5/20 0.37
▸ ATRIP Q8WXE1 5/20 0.37
▸ PIK3CB P42338 5/20 0.35
▸ MTOR P42345 6/20 0.35
▸ SERPINA2 P20848 1/20 0.35
▸ PIK3CA P42336 5/20 0.35
▸ PIK3CD O00329 1/20 0.34
▸ PIK3R1 P27986 1/20 0.34

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
SCHEMBL21541770 1.00 ATM (0.49) ATMPRKDCHRH4ATRATRIP
SCHEMBL21541780 0.90 ATM (0.51) ATMPRKDCHRH4ATRATRIP
SCHEMBL27123627 0.90 ATM (0.49) ATMPRKDCATRATRIPPIK3CB
SCHEMBL21541906 0.90 ATM (0.49) ATMPRKDCATRATRIPPIK3CB
SCHEMBL21541824 0.90 ATM (0.49) ATMPRKDCATRATRIPPIK3CB
SCHEMBL27124026 0.90 ATM (0.49) ATMPRKDCATRATRIPPIK3CB
SCHEMBL21541829 0.88 ATM (0.63) ATMPRKDCATRPIK3CBMTOR
SCHEMBL27129299 0.88 ATM (0.63) ATMPRKDCATRPIK3CBMTOR
SCHEMBL21541729 0.88 ATM (0.45) ATMPRKDCATRATRIPPIK3CB
SCHEMBL20374560 0.88 ATM (0.50) ATMPRKDCATRATRIPPIK3CB

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
EP-3567041-B1 SUBSTITUTED FUSED HETEROARYL COMPOUND SERVING AS A KINASE INHIBITOR, AND APPLICATIONS THEREOF IMPACT THERAPEUTICS SHANGHAI INC (CN) 2023-12-27 — — EP disclosed
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