SCHEMBL20204540

SCHEMBL20204540

CN(c1ccc(-c2ccc(-c3cccc(-c4cc(-c5ccccc5)ccc4N(C)c4ccc5c(c4)C(C)(C)c4ccccc4-5)c3)cc2)cc1)c1ccc(-c2ccccc2)cc1-c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 11/20 0.42
PGR P06401 4/20 0.32
MAPT P10636 2/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
MEN1 O00255 1/20 0.32
APAF1 O14727 1/20 0.32
NPC1 O15118 1/20 0.32
LMNA P02545 1/20 0.32
THRB P10828 1/20 0.32
XBP1 P17861 1/20 0.32
PTBP1 P26599 1/20 0.32
HTT P42858 1/20 0.32
RAB9A P51151 1/20 0.32
GALK1 P51570 1/20 0.32
BLM P54132 1/20 0.32
SMAD3 P84022 1/20 0.32
KMT2A Q03164 1/20 0.32
ATM Q13315 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
NPSR1 Q6W5P4 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
SCHEMBL20091202 1.00 PDK2 (0.42) PDK2PGRMAPTL3MBTL1MEN1
SCHEMBL19844099 0.95 PDK2 (0.42) PDK2PGRMAPTL3MBTL1MEN1
SCHEMBL20091254 0.93 PDK2 (0.42) PDK2PGRMAPTL3MBTL1MEN1
SCHEMBL19742385 0.91 PDK2 (0.44) PDK2PGR
SCHEMBL24505642 0.90 PDK2 (0.41) PDK2PGRMAPTL3MBTL1MEN1
SCHEMBL19735319 0.89 PDK2 (0.51) PDK2PGRMAPTL3MBTL1MEN1
SCHEMBL19849790 0.88 PDK2 (0.46) PDK2PGR
SCHEMBL19163545 0.88 PDK2 (0.44) PDK2PGRMAPTL3MBTL1MEN1
SCHEMBL22807874 0.87 PDK2 (0.44) PDK2PGR
SCHEMBL26834097 0.87 PDK2 (0.36) PDK2PGRMAPTL3MBTL1MEN1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10873035-B2 Heterocyclic compound and organic light emitting diode containing same LG CHEM, LTD. 2020-12-22 US disclosed
US-10800969-B2 Heterocyclic compound and organic light emitting element comprising same LG CHEM, LTD. (KR) 2020-10-13 US disclosed
US-20180148641-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME LG CHEM, LTD. (KR) 2018-05-31 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10800969-B2 Heterocyclic compound and organic light emitting element comprising same CRY1, CRY2, PER2 PDK2 2769/4885PGR 1513/4885MAPT 1231/4885
US-20180148641-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME CRY1, CRY2, PER2 PDK2 2374/4885PGR 1344/4885MAPT 1057/4885
US-10873035-B2 Heterocyclic compound and organic light emitting diode containing same CRY1, CRY2, PER2 PDK2 1602/4885PGR 1604/4885MAPT 1466/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.