SCHEMBL21393987

SCHEMBL21393987

c1ccc(-c2ccc(-c3nc(-c4ccc(-c5ccccc5)cc4)nc(-c4ccc(-c5ccc6c(c5)C5(c7ccccc7-c7ccccc75)c5cccc7c8ccccc8n-6c57)cc4)n3)cc2)cc1

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DUSP3 P51452 1/20 0.35
PDK2 Q15119 5/20 0.34
LMNA P02545 2/20 0.33
POLB P06746 1/20 0.33
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
ALDH1A1 P00352 2/20 0.33
MAPT P10636 2/20 0.33
HPGD P15428 2/20 0.33
KDM4E B2RXH2 1/20 0.32
GLA P06280 1/20 0.32
NTSR1 P30989 1/20 0.30
TSHR P16473 1/20 0.30

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
SCHEMBL21394432 1.00 DUSP3 (0.35) DUSP3PDK2LMNAPOLBMEN1
SCHEMBL21393982 1.00 DUSP3 (0.35) DUSP3PDK2LMNAPOLBMEN1
SCHEMBL15908627 1.00 DUSP3 (0.35) DUSP3PDK2LMNAPOLBMEN1
SCHEMBL21276333 0.99 DUSP3 (0.34) DUSP3PDK2LMNAPOLBMEN1
SCHEMBL21394344 0.98 DUSP3 (0.34) DUSP3PDK2LMNAPOLBMEN1
SCHEMBL21394454 0.98 DUSP3 (0.34) DUSP3PDK2LMNAPOLBMEN1
SCHEMBL21394450 0.98 DUSP3 (0.34) DUSP3PDK2LMNAPOLBMEN1
SCHEMBL21394427 0.98 DUSP3 (0.34) DUSP3PDK2LMNAPOLBMEN1
SCHEMBL21394455 0.98 DUSP3 (0.34) DUSP3PDK2LMNAPOLBMEN1
SCHEMBL21394342 0.98 DUSP3 (0.35) DUSP3PDK2LMNAPOLBMEN1

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