SCHEMBL23936141

SCHEMBL23936141

CC1(C)c2cc(-c3nc(-c4ccccc4)nc(-c4cccc5oc6ccccc6c45)n3)ccc2-c2c(ccc3ccc4ccccc4c23)C1(C)C

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.33
MAPT P10636 4/20 0.33
KDM4E B2RXH2 3/20 0.33
HPGD P15428 3/20 0.33
TDP1 Q9NUW8 2/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
MAPK1 P28482 2/20 0.33
TSHR P16473 2/20 0.33
HSD17B10 Q99714 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
TP53 P04637 1/20 0.33
NFKB1 P19838 1/20 0.33
NFKB2 Q00653 1/20 0.33
RELA Q04206 1/20 0.33
ATM Q13315 1/20 0.33
ABCG2 Q9UNQ0 4/20 0.32
CYP1A1 P04798 1/20 0.32
CYP1A2 P05177 1/20 0.32
FYN P06241 1/20 0.32
MAPK3 P27361 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
SCHEMBL23936070 0.92 MAPK1 (0.32) ALDH1A1MAPTKDM4EHPGDTDP1
SCHEMBL23936582 0.91 TERT (0.32) TDP1L3MBTL1TSHRTERT
SCHEMBL23936795 0.90 ALDH1A1 (0.33) ALDH1A1MAPTKDM4EHPGDTDP1
SCHEMBL23936201 0.89 TERT (0.32) ALDH1A1MAPTKDM4EHPGDTDP1
SCHEMBL23936267 0.89 TERT (0.34) ALDH1A1MAPTKDM4EHPGDTDP1
SCHEMBL23936603 0.89 ALDH1A1 (0.36) ALDH1A1MAPTKDM4EHPGDTDP1
SCHEMBL23936466 0.88 TERT (0.32) ALDH1A1MAPTKDM4EHPGDTDP1
SCHEMBL23936293 0.88 TERT (0.32) ALDH1A1MAPTKDM4EHPGDTDP1
SCHEMBL23936731 0.88 ALDH1A1 (0.34) ALDH1A1MAPTKDM4EHPGDTDP1
SCHEMBL23936733 0.87 TERT (0.31) ALDH1A1MAPTKDM4EHPGDTDP1

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