SCHEMBL23936248

SCHEMBL23936248

CC1(C)c2ccccc2-c2cc(-c3nc(-c4ccccc4)nc(-c4ccc5c(c4)oc4ccccc45)n3)ccc2C1(C)C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 0.38
MAPT P10636 7/20 0.38
MEN1 O00255 6/20 0.38
ALDH1A1 P00352 4/20 0.38
HPGD P15428 3/20 0.38
KDM4E B2RXH2 2/20 0.38
AHR P35869 2/20 0.35
TSHR P16473 2/20 0.35
HTT P42858 2/20 0.35
LMNA P02545 2/20 0.35
POLB P06746 1/20 0.35
PGR P06401 1/20 0.34
ATM Q13315 1/20 0.34
HCRTR1 O43613 1/20 0.34
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
MMP12 P39900 1/20 0.33
MMP13 P45452 1/20 0.33
TTR P02766 1/20 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
SCHEMBL23936223 0.94 KMT2A (0.38) KMT2AMAPTMEN1ALDH1A1HPGD
SCHEMBL23936274 0.93 AHR (0.35) KMT2AMAPTMEN1ALDH1A1HPGD
SCHEMBL22058561 0.93 KMT2A (0.38) KMT2AMAPTMEN1ALDH1A1HPGD
SCHEMBL27069015 0.92 KMT2A (0.37) KMT2AMAPTMEN1ALDH1A1HPGD
SCHEMBL23936723 0.91 MAPT (0.35) KMT2AMAPTMEN1ALDH1A1HPGD
SCHEMBL22987016 0.90 MAPT (0.39) KMT2AMAPTMEN1ALDH1A1HPGD
SCHEMBL23936124 0.90 MMP12 (0.35) KMT2AMAPTMEN1ALDH1A1HPGD
SCHEMBL23935959 0.90 AHR (0.33) KMT2AMAPTMEN1ALDH1A1HPGD
SCHEMBL24039127 0.89 MAPT (0.38) KMT2AMAPTMEN1ALDH1A1HPGD
SCHEMBL24647029 0.89 MAPT (0.38) KMT2AMAPTMEN1ALDH1A1HPGD

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