SCHEMBL23936207

SCHEMBL23936207

CC1(C)c2ccc(-c3nc(-c4ccccc4)nc(-c4ccc5ccccc5c4)n3)cc2-c2cccc(-c3ccccc3)c2C1(C)C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.39
MEN1 O00255 4/20 0.39
KMT2A Q03164 4/20 0.39
KDM4E B2RXH2 4/20 0.39
TP53 P04637 1/20 0.39
CYP1A2 P05177 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
HSD17B10 Q99714 1/20 0.39
MAPT P10636 5/20 0.36
HPGD P15428 4/20 0.36
ADORA2A P29274 2/20 0.36
ADORA1 P30542 2/20 0.36
LMNA P02545 4/20 0.35
GLA P06280 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.34
HSD17B1 P14061 2/20 0.34
HSD17B2 P37059 2/20 0.34
CYP1A1 P04798 1/20 0.34
CYP1B1 Q16678 1/20 0.34
PTGER3 P43115 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
SCHEMBL23936467 0.94 MEN1 (0.41) ALDH1A1MEN1KMT2AKDM4ESMN1; SMN2
SCHEMBL23935999 0.92 MEN1 (0.40) ALDH1A1MEN1KMT2AKDM4EHSD17B10
SCHEMBL23936751 0.91 MEN1 (0.39) ALDH1A1MEN1KMT2AKDM4EHSD17B10
SCHEMBL23936700 0.90 MEN1 (0.38) ALDH1A1MEN1KMT2AKDM4ESMN1; SMN2
SCHEMBL23936101 0.90 MEN1 (0.42) ALDH1A1MEN1KMT2AKDM4ETP53
SCHEMBL23936465 0.90 MEN1 (0.40) ALDH1A1MEN1KMT2AKDM4ESMN1; SMN2
SCHEMBL23936653 0.89 ALDH1A1 (0.40) ALDH1A1MEN1KMT2AKDM4ETP53
SCHEMBL23936386 0.88 MEN1 (0.43) ALDH1A1MEN1KMT2AKDM4ETP53
SCHEMBL23935984 0.87 MEN1 (0.38) ALDH1A1MEN1KMT2AKDM4ESMN1; SMN2
SCHEMBL26438248 0.87 MEN1 (0.40) 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