SCHEMBL22989124

SCHEMBL22989124

c1ccc2c(-c3ccc4c(c3)sc3ccccc34)nc(-c3ccc(-n4c5ccc6cccc7sc8cccc9ccc4c(c98)c5c67)c4ccccc34)nc2c1

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
ATM Q13315 1/20 0.32

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
SCHEMBL22989123 0.93 MEN1 (0.33) MEN1KMT2AATM
SCHEMBL18876926 0.93 MEN1 (0.33) MEN1KMT2AATM
SCHEMBL22989129 0.91 MEN1 (0.33) MEN1KMT2AATM
SCHEMBL22989122 0.90 MEN1 (0.38) MEN1KMT2AATM
SCHEMBL22989119 0.89 PRKDC (0.31) MEN1KMT2A
SCHEMBL22989120 0.89 KDM4E (0.30) ATM
SCHEMBL22989070 0.87 ALOX5 (0.31)
SCHEMBL22989183 0.87 MEN1 (0.33) MEN1KMT2AATM
SCHEMBL18876924 0.87 MEN1 (0.33) MEN1KMT2AATM
SCHEMBL22989121 0.87 CYP1A2 (0.30)

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