SCHEMBL23936133

SCHEMBL23936133

CC1(C)c2cc(-c3ccccc3)ccc2-c2c(-c3ccccc3-c3cccc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)c3)cccc2C1(C)C

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 7/20 0.36
MEN1 O00255 4/20 0.35
KMT2A Q03164 4/20 0.35
MAPT P10636 3/20 0.35
ALDH1A1 P00352 2/20 0.35
HPGD P15428 2/20 0.35
ENPP3 O14638 1/20 0.35
LMNA P02545 2/20 0.35
KDM4E B2RXH2 1/20 0.35
GLA P06280 1/20 0.35
RARB P10826 2/20 0.34
RARG P13631 2/20 0.34
RARA P10276 1/20 0.34
L3MBTL1 Q9Y468 2/20 0.33
RXRA P19793 1/20 0.33
APAF1 O14727 1/20 0.33
NPC1 O15118 1/20 0.33
THRB P10828 1/20 0.33
XBP1 P17861 1/20 0.33
PTBP1 P26599 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
SCHEMBL23936193 0.95 PDK2 (0.38) PDK2MEN1KMT2AMAPTALDH1A1
SCHEMBL23936243 0.95 PDK2 (0.38) PDK2MEN1KMT2AMAPTALDH1A1
SCHEMBL23936439 0.93 PDK2 (0.36) PDK2MEN1KMT2AMAPTALDH1A1
SCHEMBL23936715 0.93 MEN1 (0.37) PDK2MEN1KMT2AMAPTALDH1A1
SCHEMBL23936755 0.93 PDK2 (0.38) PDK2MEN1KMT2AMAPTALDH1A1
SCHEMBL23936091 0.91 MEN1 (0.38) PDK2MEN1KMT2AMAPTALDH1A1
SCHEMBL23936411 0.91 L3MBTL1 (0.38) PDK2MEN1KMT2AMAPTALDH1A1
SCHEMBL23936198 0.90 PDK2 (0.40) PDK2MEN1KMT2AMAPTALDH1A1
SCHEMBL23936208 0.90 MEN1 (0.39) PDK2MEN1KMT2AMAPTALDH1A1
SCHEMBL23936171 0.90 MEN1 (0.39) PDK2MEN1KMT2AMAPTALDH1A1

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