SCHEMBL22945954

SCHEMBL22945954

c1ccc(-c2nc(-c3cccc(N4c5ccc6ccccc6c5-c5cccc6cccc4c56)c3)nc(-c3cccc4c3sc3ccccc34)n2)cc1

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PDE6D O43924 1/20 0.34
ALOX5 P09917 1/20 0.34
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
POLB P06746 1/20 0.31
DUSP3 P51452 1/20 0.31
PTPN5 P54829 1/20 0.31
KMT2A Q03164 1/20 0.31
PTPN11 Q06124 1/20 0.31
CTDSP1 Q9GZU7 1/20 0.31

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
SCHEMBL22944699 0.91 PDE6D (0.34) PDE6DALOX5KDM4E
SCHEMBL22945953 0.91 PDE6D (0.38) PDE6DALOX5
SCHEMBL22945520 0.90 PDE6D (0.37) PDE6DALOX5KDM4EMEN1POLB
SCHEMBL22945955 0.88 PDE6D (0.35) PDE6DKDM4EMEN1POLBDUSP3
SCHEMBL21515567 0.88 ALOX5 (0.38) PDE6DALOX5KDM4EMEN1POLB
SCHEMBL22944696 0.85 ALOX5 (0.34) PDE6DALOX5POLB
SCHEMBL22945217 0.85 ALOX5 (0.36) ALOX5
SCHEMBL22945220 0.85 ALOX5 (0.36) ALOX5
SCHEMBL26736666 0.85 PDE6D (0.42) PDE6DKDM4E
SCHEMBL22944887 0.85 ALOX5 (0.36) PDE6DALOX5KDM4EMEN1POLB

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-11812658-B2 Compound and organic light emitting diode comprising same LG CHEM, LTD. (KR) 2023-11-07 US disclosed
US-11812658-B2 Compound and organic light emitting diode comprising same LG CHEM, LTD. (KR) 2023-11-07 US disclosed
US-20210036236-A1 COMPOUND AND ORGANIC LIGHT EMITTING DIODE COMPRISING SAME LG CHEM, LTD. (KR) 2021-02-04 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 (2 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-20210036236-A1 COMPOUND AND ORGANIC LIGHT EMITTING DIODE COMPRISING SAME DRD1, DRD3, DRD2 PDE6D 342/4885ALOX5 386/4885KDM4E 1857/4885
US-11812658-B2 Compound and organic light emitting diode comprising same DRD1, DRD3, DRD2 PDE6D 342/4885ALOX5 386/4885KDM4E 1857/4885

“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.