SCHEMBL23936746

SCHEMBL23936746

CC1(C)c2ccc(-c3ccc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)cc3)cc2-c2cc3c4ccccc4c4ccccc4c3cc2C1(C)C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.40
KMT2A Q03164 5/20 0.40
MAPT P10636 4/20 0.40
ALDH1A1 P00352 2/20 0.40
HPGD P15428 2/20 0.40
ATM Q13315 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
LMNA P02545 3/20 0.35
KDM4E B2RXH2 1/20 0.35
GLA P06280 1/20 0.35
KDM1A O60341 1/20 0.34
PGR P06401 1/20 0.34
ABCG2 Q9UNQ0 4/20 0.33
NTSR1 P30989 1/20 0.33
ABCB1 P08183 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
PDE5A O76074 2/20 0.33
TLR9 Q9NR96 1/20 0.33
TP53 P04637 1/20 0.33
RARA P10276 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
SCHEMBL23936456 0.96 MEN1 (0.41) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL23936406 0.95 MEN1 (0.38) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL17563661 0.89 MEN1 (0.40) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL23936388 0.88 MEN1 (0.46) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL23936385 0.88 MEN1 (0.46) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL23936150 0.86 MEN1 (0.40) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL23936152 0.85 MEN1 (0.44) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL17563690 0.85 MEN1 (0.37) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL23936149 0.85 MEN1 (0.39) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL17921535 0.84 MEN1 (0.41) MEN1KMT2AMAPTALDH1A1HPGD

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