SCHEMBL23936545

SCHEMBL23936545

CC1(C)c2cc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)ccc2-c2ccc3ccc4ccccc4c3c2C1(C)C

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.36
MAPT P10636 5/20 0.36
HPGD P15428 4/20 0.36
KDM4E B2RXH2 4/20 0.36
MEN1 O00255 7/20 0.35
KMT2A Q03164 7/20 0.35
LMNA P02545 3/20 0.35
HSD17B10 Q99714 3/20 0.35
TSHR P16473 3/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
MAPK1 P28482 2/20 0.35
ATM Q13315 2/20 0.35
TP53 P04637 1/20 0.35
NFKB1 P19838 1/20 0.35
NFKB2 Q00653 1/20 0.35
RELA Q04206 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
GLA P06280 1/20 0.35
CYP1A2 P05177 5/20 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
SCHEMBL23936349 0.98 ALDH1A1 (0.34) ALDH1A1MAPTHPGDKDM4EMEN1
SCHEMBL23936415 0.96 ALDH1A1 (0.35) ALDH1A1MAPTHPGDKDM4EMEN1
SCHEMBL23936795 0.90 ALDH1A1 (0.33) ALDH1A1MAPTHPGDKDM4EMEN1
SCHEMBL23936797 0.88 MAPT (0.36) ALDH1A1MAPTHPGDKDM4EMEN1
SCHEMBL23936247 0.87 L3MBTL1 (0.33) ALDH1A1MAPTHPGDKDM4EMEN1
SCHEMBL23936603 0.86 ALDH1A1 (0.36) ALDH1A1MAPTHPGDKDM4EMEN1
SCHEMBL23936363 0.86 MAPT (0.35) ALDH1A1MAPTHPGDKDM4EMEN1
SCHEMBL23936731 0.86 ALDH1A1 (0.34) ALDH1A1MAPTHPGDKDM4EMEN1
SCHEMBL23936564 0.85 PDK2 (0.32) ALDH1A1MAPTHPGDKDM4EMEN1
SCHEMBL23936361 0.84 MAPT (0.35) ALDH1A1MAPTHPGDKDM4EMEN1

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