SCHEMBL22945127

SCHEMBL22945127

c1ccc(-c2cccc(-c3nc(-c4cccc5oc6ccccc6c45)nc(N4c5c(ccc6ccccc56)-c5cccc6cccc4c56)n3)c2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE6D O43924 1/20 0.36
ALDH1A1 P00352 3/20 0.31
MAPT P10636 3/20 0.31
KDM4E B2RXH2 2/20 0.31
HPGD P15428 2/20 0.31
TSHR P16473 2/20 0.31
HSD17B10 Q99714 2/20 0.31
TDP1 Q9NUW8 2/20 0.31
L3MBTL1 Q9Y468 2/20 0.31
TP53 P04637 1/20 0.31
NFKB1 P19838 1/20 0.31
MAPK1 P28482 1/20 0.31
NFKB2 Q00653 1/20 0.31
RELA Q04206 1/20 0.31
ATM Q13315 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
ALOX15 P16050 1/20 0.31
CASP1 P29466 1/20 0.31
CASP7 P55210 1/20 0.31
PLA2G2A P14555 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
SCHEMBL22945075 0.95 PDE6D (0.36) PDE6DALDH1A1MAPTKDM4EHPGD
SCHEMBL22945980 0.92 TDP1 (0.35) PDE6DALDH1A1MAPTKDM4EHPGD
SCHEMBL22944790 0.90 PDE6D (0.32) PDE6DALDH1A1MAPTKDM4EHPGD
SCHEMBL26736922 0.90 PDE6D (0.35) PDE6DALDH1A1MAPTKDM4EHPGD
SCHEMBL22945106 0.90 PDE6D (0.39) PDE6DALDH1A1MAPTKDM4EHPGD
SCHEMBL22945583 0.88 PDE6D (0.43) PDE6DALDH1A1MAPTKDM4EHPGD
SCHEMBL22945017 0.88 PDE6D (0.34) PDE6DALDH1A1MAPTKDM4EHPGD
SCHEMBL22945125 0.88 PDE6D (0.38) PDE6DALDH1A1MAPTKDM4EHPGD
SCHEMBL22945939 0.87 PDE6D (0.35) PDE6DALDH1A1MAPTKDM4EHPGD
SCHEMBL22946000 0.87 PDE6D (0.37) PDE6DALDH1A1HPGDTSHRHSD17B10

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 342/4885ALDH1A1 271/4885MAPT 2771/4885
US-11812658-B2 Compound and organic light emitting diode comprising same DRD1, DRD3, DRD2 PDE6D 342/4885ALDH1A1 271/4885MAPT 2771/4885

“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.