SCHEMBL23936386

SCHEMBL23936386

CC1(C)c2ccc(-c3ccccc3)cc2-c2cc(-c3nc(-c4ccccc4)nc(-c4ccc5ccccc5c4)n3)ccc2C1(C)C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.43
ALDH1A1 P00352 3/20 0.43
KMT2A Q03164 3/20 0.43
KDM4E B2RXH2 2/20 0.43
TP53 P04637 1/20 0.43
CYP1A2 P05177 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
HSD17B10 Q99714 1/20 0.43
LPL P06858 1/20 0.41
LIPG Q9Y5X9 1/20 0.41
MAPT P10636 2/20 0.41
HPGD P15428 2/20 0.41
ESR1 P03372 3/20 0.40
ESR2 Q92731 3/20 0.40
ADORA2A P29274 1/20 0.40
ADORA1 P30542 1/20 0.40
CYP11B1 P15538 2/20 0.40
CYP11B2 P19099 2/20 0.40
CYP17A1 P05093 1/20 0.40
CYP19A1 P11511 1/20 0.40

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
SCHEMBL26438248 0.96 MEN1 (0.40) MEN1ALDH1A1KMT2AKDM4ETP53
SCHEMBL26438252 0.94 LPL (0.40) MEN1ALDH1A1KMT2AKDM4ETP53
SCHEMBL23936101 0.93 MEN1 (0.42) MEN1ALDH1A1KMT2AKDM4ETP53
SCHEMBL26438312 0.93 MEN1 (0.40) MEN1ALDH1A1KMT2AKDM4ETP53
SCHEMBL26438307 0.93 MEN1 (0.40) MEN1ALDH1A1KMT2AKDM4ETP53
SCHEMBL23936385 0.93 MEN1 (0.46) MEN1ALDH1A1KMT2AKDM4ESMN1; SMN2
SCHEMBL23936388 0.93 MEN1 (0.46) MEN1ALDH1A1KMT2AKDM4ESMN1; SMN2
SCHEMBL23936483 0.92 MEN1 (0.38) MEN1ALDH1A1KMT2AKDM4ETP53
SCHEMBL25796494 0.91 MEN1 (0.43) MEN1ALDH1A1KMT2AKDM4ETP53
SCHEMBL26438308 0.90 ADORA2A (0.38) MEN1ALDH1A1KMT2AKDM4ETP53

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