SCHEMBL22945214

SCHEMBL22945214

c1ccc(-c2nc(-c3cccc(N4c5ccccc5-c5cccc6cccc4c56)c3)nc(-c3cccc4oc5ccccc5c34)n2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE6D O43924 1/20 0.39
TP53 P04637 3/20 0.37
HPSE Q9Y251 3/20 0.34
KDM4E B2RXH2 4/20 0.33
ALDH1A1 P00352 3/20 0.33
HPGD P15428 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
HSD17B10 Q99714 2/20 0.33
TSHR P16473 2/20 0.33
MAPT P10636 1/20 0.33
NFKB1 P19838 1/20 0.33
MAPK1 P28482 1/20 0.33
NFKB2 Q00653 1/20 0.33
RELA Q04206 1/20 0.33
ATM Q13315 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
PKM P14618 1/20 0.33

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
SCHEMBL26737196 0.93 PDE6D (0.37) PDE6DTP53HPSEKDM4EALDH1A1
SCHEMBL26736446 0.91 ALOX5 (0.37) PDE6DTP53HPSEKDM4EALDH1A1
SCHEMBL22945569 0.91 PDE6D (0.40) PDE6DTP53HPSEKDM4EALDH1A1
SCHEMBL22945426 0.90 PDE6D (0.38) PDE6DTP53KDM4EALDH1A1HPGD
SCHEMBL22945480 0.89 PDE6D (0.38) PDE6DTP53KDM4EALDH1A1HPGD
SCHEMBL21515572 0.87 PDE6D (0.36) PDE6DTP53KDM4EALDH1A1HPGD
SCHEMBL22945106 0.87 PDE6D (0.39) PDE6DTP53KDM4EALDH1A1HPGD
SCHEMBL22944886 0.87 PDE6D (0.44) PDE6DTP53KDM4EALDH1A1HPGD
SCHEMBL22945682 0.85 PDE6D (0.52) PDE6DTP53HPSEKDM4EALDH1A1
SCHEMBL22945568 0.85 PDE6D (0.46) PDE6DTP53KDM4EALDH1A1HPGD

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 342/4885TP53 4333/4885HPSE 4346/4885
US-11812658-B2 Compound and organic light emitting diode comprising same DRD1, DRD3, DRD2 PDE6D 342/4885TP53 4333/4885HPSE 4346/4885

“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.