SCHEMBL23936637

SCHEMBL23936637

CC1(C)c2ccccc2-c2cc3ccc4ccc(-c5nc(-c6ccccc6)nc(-c6cccc7oc8ccccc8c67)n5)cc4c3cc2C1(C)C

nearest known ligand 0.33

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.32
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
TP53 P04637 1/20 0.32
MAPT P10636 1/20 0.32
HPGD P15428 1/20 0.32
NFKB1 P19838 1/20 0.32
MAPK1 P28482 1/20 0.32
NFKB2 Q00653 1/20 0.32
RELA Q04206 1/20 0.32
ATM Q13315 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HSD17B10 Q99714 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
TERT O14746 2/20 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
SCHEMBL23936633 0.93 ALDH1A1 (0.33) TSHRKDM4EALDH1A1TP53MAPT
SCHEMBL23936192 0.91 TERT (0.31) TSHRKDM4EALDH1A1MAPTHPGD
SCHEMBL23936267 0.90 TERT (0.34) TSHRKDM4EALDH1A1TP53MAPT
SCHEMBL23936184 0.90 TERT (0.34) TSHRKDM4EALDH1A1TP53MAPT
SCHEMBL23936319 0.89 KMT2A (0.35) TSHRKDM4EALDH1A1TP53MAPT
SCHEMBL26438369 0.88 TERT (0.33) TSHRKDM4EALDH1A1TP53MAPT
SCHEMBL26438293 0.88 PDK2 (0.36) TSHRKDM4EALDH1A1TP53MAPT
SCHEMBL26438269 0.88 PDK2 (0.33) TSHRKDM4EALDH1A1TP53MAPT
SCHEMBL23936639 0.87 MEN1 (0.38) TSHRKDM4EALDH1A1TP53MAPT
SCHEMBL23936405 0.87 TERT (0.33) TSHRKDM4EALDH1A1TP53MAPT

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