SCHEMBL22945177

SCHEMBL22945177

c1ccc(-c2ccc(-c3nc4ccccc4nc3N3c4cc5ccccc5cc4-c4cccc5cccc3c45)cc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE6D O43924 1/20 0.45
CASP1 P29466 2/20 0.38
HSD17B10 Q99714 2/20 0.38
HRH4 Q9H3N8 1/20 0.38
ALDH1A1 P00352 6/20 0.36
TP53 P04637 1/20 0.36
HPGD P15428 1/20 0.36
TSHR P16473 1/20 0.36
MAPK1 P28482 1/20 0.36
CASP7 P55210 1/20 0.36
HIF1A Q16665 1/20 0.36
KDM4E B2RXH2 8/20 0.36
L3MBTL1 Q9Y468 6/20 0.36
LMNA P02545 5/20 0.36
TDP1 Q9NUW8 3/20 0.36
NPSR1 Q6W5P4 1/20 0.36
GAA P10253 2/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL22945176 0.98 PDE6D (0.41) PDE6DCASP1HSD17B10HRH4ALDH1A1
SCHEMBL21515606 0.91 PDE6D (0.37) PDE6DCASP1HSD17B10HRH4ALDH1A1
SCHEMBL21515228 0.90 PDE6D (0.49) PDE6DCASP1HSD17B10HRH4ALDH1A1
SCHEMBL22945526 0.88 PDE6D (0.54) PDE6DCASP1HSD17B10ALDH1A1TP53
SCHEMBL21515235 0.87 PDE6D (0.45) PDE6DCASP1HSD17B10HRH4ALDH1A1
SCHEMBL22945528 0.87 PDE6D (0.52) PDE6DCASP1HSD17B10ALDH1A1TP53
SCHEMBL22946047 0.84 ALDH1A1 (0.40) PDE6DCASP1HSD17B10ALDH1A1TP53
SCHEMBL22946046 0.84 ALDH1A1 (0.37) PDE6DCASP1HSD17B10ALDH1A1TP53
SCHEMBL21515227 0.83 PDE6D (0.39) PDE6DCASP1HSD17B10HRH4ALDH1A1
SCHEMBL22945350 0.82 HSP90AA1 (0.33) PDE6DCASP1HSD17B10ALDH1A1TP53

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 342/4885CASP1 2095/4885HSD17B10 1212/4885
US-11812658-B2 Compound and organic light emitting diode comprising same DRD1, DRD3, DRD2 PDE6D 342/4885CASP1 2095/4885HSD17B10 1212/4885

“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.