SCHEMBL22700330

SCHEMBL22700330

c1ccc(-c2nc(-c3ccc(-c4ccc5sc6c(-c7ccc(-c8nc(-c9ccccc9)c9ccccc9n8)cc7)cccc6c5c4)cc3)nc3ccccc23)cc1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
ATM Q13315 1/20 0.50
ALOX5 P09917 1/20 0.41
LIMK1 P53667 2/20 0.39
WHR1 P49842 1/20 0.39
PDK1 Q15118 2/20 0.38
NUDT1 P36639 3/20 0.37
GAA P10253 1/20 0.37
MAPT P10636 1/20 0.37
ADORA2A P29274 1/20 0.37
PIM3 Q86V86 2/20 0.36
PIM1 P11309 1/20 0.35
PIM2 Q9P1W9 1/20 0.35
ABCG2 Q9UNQ0 5/20 0.34
PDE5A O76074 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
SCHEMBL22700308 1.00 MEN1 (0.50) MEN1KMT2AATMALOX5LIMK1
SCHEMBL22700304 0.92 MEN1 (0.52) MEN1KMT2AATMALOX5LIMK1
SCHEMBL22700411 0.92 MEN1 (0.48) MEN1KMT2AATMALOX5LIMK1
SCHEMBL24266634 0.91 ALOX5 (0.47) MEN1KMT2AATMALOX5LIMK1
SCHEMBL22700305 0.91 MEN1 (0.53) MEN1KMT2AATMALOX5LIMK1
SCHEMBL22700301 0.91 MEN1 (0.53) MEN1KMT2AATMALOX5LIMK1
SCHEMBL22700476 0.91 MEN1 (0.50) MEN1KMT2AATMALOX5LIMK1
SCHEMBL22700485 0.91 MEN1 (0.50) MEN1KMT2AATMALOX5LIMK1
SCHEMBL22700405 0.91 MEN1 (0.49) MEN1KMT2AATMALOX5LIMK1
SCHEMBL22700401 0.91 MEN1 (0.49) MEN1KMT2AATMALOX5LIMK1

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-2020235976-A1 NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING SAME 주식회사 엘지화학 (KR) 2020-11-26 WO disclosed