SCHEMBL22989249

SCHEMBL22989249

c1ccc2c(c1)oc1cc(-c3nc(-c4ccc5c(c4)oc4ccccc45)nc(-c4ccc(-n5c6ccc7cccc8sc9cccc%10ccc5c(c%109)c6c78)c5ccccc45)n3)ccc12

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PRKDC P78527 2/20 0.33

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
SCHEMBL22988914 0.92 PRKDC (0.33) PRKDC
SCHEMBL22989119 0.90 PRKDC (0.31) PRKDC
SCHEMBL22989071 0.90 PRKDC (0.32) PRKDC
SCHEMBL22988986 0.89 SIRT2 (0.32)
SCHEMBL22989075 0.88 PRKDC (0.35) PRKDC
SCHEMBL22989092 0.87 PRKDC (0.33) PRKDC
SCHEMBL22989245 0.86 ALOX5 (0.32) PRKDC
SCHEMBL22989040 0.84 PRKDC (0.36) PRKDC
SCHEMBL22989206 0.82 PRKDC (0.31) PRKDC
SCHEMBL22988989 0.82 NPC1 (0.34)

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
WO-2021029757-A1 NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING SAME 주식회사 엘지화학 2021-02-18 WO disclosed