SCHEMBL23936456

SCHEMBL23936456

CC1(C)c2ccc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)cc2-c2cc3c4ccccc4c4ccccc4c3cc2C1(C)C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 7/20 0.41
KMT2A Q03164 7/20 0.41
MAPT P10636 5/20 0.41
HPGD P15428 3/20 0.41
ALDH1A1 P00352 3/20 0.41
ATM Q13315 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
LMNA P02545 5/20 0.36
KDM4E B2RXH2 2/20 0.36
GLA P06280 1/20 0.36
ABCG2 Q9UNQ0 6/20 0.34
ABCB1 P08183 2/20 0.34
ABCC1 P33527 1/20 0.34
NTSR1 P30989 1/20 0.34
WHR1 P49842 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
CYP1A2 P05177 4/20 0.33
CYP3A4 P08684 4/20 0.33
CYP2D6 P10635 4/20 0.33
CYP2C19 P33261 4/20 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
SCHEMBL23936406 0.96 MEN1 (0.38) MEN1KMT2AMAPTHPGDALDH1A1
SCHEMBL23936746 0.96 MEN1 (0.40) MEN1KMT2AMAPTHPGDALDH1A1
SCHEMBL16940928 0.89 MEN1 (0.41) MEN1KMT2AMAPTHPGDALDH1A1
SCHEMBL23936388 0.86 MEN1 (0.46) MEN1KMT2AMAPTHPGDALDH1A1
SCHEMBL23936385 0.86 MEN1 (0.46) MEN1KMT2AMAPTHPGDALDH1A1
SCHEMBL23936405 0.86 TERT (0.33) MEN1KMT2AMAPTHPGDALDH1A1
SCHEMBL23936427 0.85 MEN1 (0.45) MEN1KMT2AMAPTHPGDALDH1A1
SCHEMBL17563666 0.85 MEN1 (0.38) MEN1KMT2AMAPTHPGDALDH1A1
SCHEMBL17563661 0.84 MEN1 (0.40) MEN1KMT2AMAPTHPGDALDH1A1
SCHEMBL17921536 0.84 MEN1 (0.41) MEN1KMT2AMAPTHPGDALDH1A1

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