SCHEMBL23936215

SCHEMBL23936215

c1ccc(-c2nc(-c3ccccc3)c3ccc(-c4ccc5c(c4)-c4ccccc4C(c4ccccc4)(c4ccccc4)C5(c4ccccc4)c4ccccc4)cc3n2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.48
MEN1 O00255 3/20 0.48
ATM Q13315 2/20 0.48
WHR1 P49842 1/20 0.42
HPGD P15428 3/20 0.38
DHFR P00374 1/20 0.35
DPP4 P27487 4/20 0.33
PDK1 Q15118 1/20 0.32
NPC1 O15118 1/20 0.32
MAPK1 P28482 1/20 0.32
HTT P42858 1/20 0.32
RAB9A P51151 1/20 0.32
ABCG2 Q9UNQ0 1/20 0.32
ADK P55263 1/20 0.32
ADORA2A P29274 1/20 0.32
NUDT1 P36639 1/20 0.32
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32
PDE5A O76074 1/20 0.32
TLR9 Q9NR96 1/20 0.31

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
SCHEMBL23936177 0.92 KMT2A (0.46) KMT2AMEN1ATMWHR1HPGD
SCHEMBL23936717 0.90 MEN1 (0.53) KMT2AMEN1ATMWHR1HPGD
SCHEMBL23936492 0.87 MEN1 (0.49) KMT2AMEN1ATMWHR1HPGD
SCHEMBL18455546 0.87 MEN1 (0.49) KMT2AMEN1ATMWHR1HPGD
SCHEMBL23936297 0.86 MEN1 (0.46) KMT2AMEN1ATMWHR1HPGD
SCHEMBL23936277 0.83 MEN1 (0.50) KMT2AMEN1ATMWHR1HPGD
SCHEMBL23936775 0.82 KMT2A (0.49) KMT2AMEN1ATMHPGDNPC1
SCHEMBL23936199 0.82 MEN1 (0.44) KMT2AMEN1ATMHPGDNPC1
SCHEMBL18455541 0.81 MEN1 (0.48) KMT2AMEN1ATMWHR1HPGD
SCHEMBL24647374 0.81 MEN1 (0.58) KMT2AMEN1ATMWHR1HPGD

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
US-20210328150-A1 ORGANIC ELECTROLUMINESCENT COMPOUND, ORGANIC ELECTROLUMINESCENT MATERIAL COMPRISING THE SAME, AND ORGANIC ELECTROLUMINESCENT DEVICE DUPONT SPECIALTY MATERIALS KOREA LTD. (KR) 2021-10-21 US disclosed