SCHEMBL23936653

SCHEMBL23936653

CC1(C)c2ccccc2-c2cccc(-c3nc(-c4ccccc4)nc(-c4ccc5ccccc5c4)n3)c2C1(C)C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.40
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
KDM4E B2RXH2 3/20 0.40
TP53 P04637 1/20 0.40
CYP1A2 P05177 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
HSD17B10 Q99714 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.35
HSD17B1 P14061 1/20 0.35
HSD17B2 P37059 1/20 0.35
CYP1A1 P04798 1/20 0.35
CYP1B1 Q16678 1/20 0.35
ADORA2A P29274 3/20 0.34
ADORA1 P30542 3/20 0.34
MAPT P10636 3/20 0.34
HPGD P15428 3/20 0.34
ADORA3 P0DMS8 1/20 0.34
ALOX15 P16050 1/20 0.34
TSHR P16473 1/20 0.34

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
SCHEMBL23936513 0.90 ALDH1A1 (0.36) ALDH1A1MEN1KMT2AKDM4ETP53
SCHEMBL23936424 0.89 L3MBTL1 (0.39) ALDH1A1MEN1KMT2AKDM4ETP53
SCHEMBL23935955 0.89 L3MBTL1 (0.41) ALDH1A1MEN1KMT2AKDM4ETP53
SCHEMBL23936687 0.89 L3MBTL1 (0.43) ALDH1A1MEN1KMT2AKDM4ETP53
SCHEMBL23936207 0.89 ALDH1A1 (0.39) ALDH1A1MEN1KMT2AKDM4ETP53
SCHEMBL23936101 0.88 MEN1 (0.42) ALDH1A1MEN1KMT2AKDM4ETP53
SCHEMBL23935972 0.88 MEN1 (0.42) ALDH1A1MEN1KMT2AKDM4ETP53
SCHEMBL23936285 0.87 MEN1 (0.40) ALDH1A1MEN1KMT2AKDM4ETP53
SCHEMBL26438248 0.86 MEN1 (0.40) ALDH1A1MEN1KMT2AKDM4ETP53
SCHEMBL26438212 0.86 PDK2 (0.42) ALDH1A1MEN1KMT2AKDM4ETP53

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