SCHEMBL22945006

SCHEMBL22945006

c1ccc(-c2nc(-c3cccc(N4c5c(ccc6ccccc56)-c5cccc6cccc4c56)c3)nc(-c3ccc4oc5ccccc5c4c3)n2)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE6D O43924 1/20 0.37
SIRT2 Q8IXJ6 1/20 0.35
SIRT1 Q96EB6 1/20 0.35
KDM4E B2RXH2 5/20 0.34
HPGD P15428 4/20 0.34
MAPT P10636 3/20 0.34
TSHR P16473 3/20 0.34
HSD17B10 Q99714 3/20 0.34
ALDH1A1 P00352 3/20 0.34
TP53 P04637 3/20 0.34
ALOX15 P16050 1/20 0.34
CASP1 P29466 1/20 0.34
CASP7 P55210 1/20 0.34
HPSE Q9Y251 6/20 0.33
MAPK1 P28482 2/20 0.32
PTGER4 P35408 1/20 0.32
KMT2A Q03164 1/20 0.32
TDP1 Q9NUW8 2/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
NFKB1 P19838 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
SCHEMBL22945076 0.93 PDE6D (0.37) PDE6DSIRT2SIRT1KDM4EHPGD
SCHEMBL22944805 0.91 PDE6D (0.35) PDE6DSIRT2SIRT1KDM4EHPGD
SCHEMBL22945454 0.90 PDE6D (0.31) PDE6DTP53
SCHEMBL22945978 0.90 PDE6D (0.34) PDE6DSIRT2SIRT1KDM4EHPGD
SCHEMBL22945130 0.89 PDE6D (0.34) PDE6DSIRT2SIRT1KDM4EHPGD
SCHEMBL21515449 0.89 TP53 (0.37) PDE6DSIRT2SIRT1KDM4EHPGD
SCHEMBL22945074 0.87 PDE6D (0.37) PDE6DKDM4EHPGDMAPTTSHR
SCHEMBL22945124 0.87 PDE6D (0.32) PDE6DSIRT2SIRT1KDM4EHPGD
SCHEMBL22944792 0.87 PRKDC (0.33) PDE6DSIRT2SIRT1KDM4EHPGD
SCHEMBL22945125 0.87 PDE6D (0.38) PDE6DKDM4EHPGDMAPTTSHR

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 342/4885SIRT2 792/4885SIRT1 644/4885
US-11812658-B2 Compound and organic light emitting diode comprising same DRD1, DRD3, DRD2 PDE6D 342/4885SIRT2 792/4885SIRT1 644/4885

“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.