SCHEMBL21394230

SCHEMBL21394230

c1ccc(-c2ccc(-c3ccc(-c4nc(-c5ccccc5)nc(-c5ccc6c(c5)C5(c7ccccc7-c7ccccc75)c5ccccc5-6)n4)cc3)cc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 11/20 0.46
MEN1 O00255 4/20 0.46
KMT2A Q03164 4/20 0.46
MAPT P10636 3/20 0.46
ALDH1A1 P00352 2/20 0.46
HPGD P15428 2/20 0.46
NTSR1 P30989 1/20 0.42
LMNA P02545 3/20 0.41
KDM4E B2RXH2 2/20 0.41
GLA P06280 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
ADORA2A P29274 2/20 0.40
ADORA1 P30542 2/20 0.40
ADORA3 P0DMS8 1/20 0.38
ALOX15 P16050 1/20 0.38
TSHR P16473 1/20 0.38
ADORA2B P29275 1/20 0.38
POLB P06746 1/20 0.38
OPRK1 P41145 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL12133749 1.00 PDK2 (0.46) PDK2MEN1KMT2AMAPTALDH1A1
SCHEMBL12133767 1.00 PDK2 (0.46) PDK2MEN1KMT2AMAPTALDH1A1
SCHEMBL12133696 1.00 PDK2 (0.46) PDK2MEN1KMT2AMAPTALDH1A1
SCHEMBL12133764 1.00 PDK2 (0.46) PDK2MEN1KMT2AMAPTALDH1A1
SCHEMBL29373321 1.00 PDK2 (0.46) PDK2MEN1KMT2AMAPTALDH1A1
SCHEMBL12133758 1.00 PDK2 (0.46) PDK2MEN1KMT2AMAPTALDH1A1
SCHEMBL12133751 1.00 PDK2 (0.46) PDK2MEN1KMT2AMAPTALDH1A1
SCHEMBL12133761 1.00 PDK2 (0.46) PDK2MEN1KMT2AMAPTALDH1A1
SCHEMBL24039313 0.98 PDK2 (0.45) PDK2MEN1KMT2AMAPTALDH1A1
SCHEMBL19164071 0.98 PDK2 (0.45) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11239425-B2 Organic light emitting device LG CHEM, LTD. (KR) 2022-02-01 US disclosed
US-20190296243-A1 ORGANIC LIGHT EMITTING DEVICE LG CHEM, LTD. (KR) 2019-09-26 US disclosed