SCHEMBL22945665

SCHEMBL22945665

c1ccc2cc3c(cc2c1)-c1cccc2cccc(c12)N3c1ccc2cc(-c3nc4ccccc4nc3-c3cccc4ccccc34)ccc2c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE6D O43924 1/20 0.38
CYP1A2 P05177 1/20 0.33
ALDH1A1 P00352 3/20 0.32
HPGD P15428 2/20 0.32
TSHR P16473 2/20 0.32
MAPK1 P28482 2/20 0.32
CASP1 P29466 2/20 0.32
HIF1A Q16665 2/20 0.32
HSD17B10 Q99714 2/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
TP53 P04637 2/20 0.32
CASP7 P55210 1/20 0.32
MET P08581 1/20 0.32
PIM1 P11309 2/20 0.32
POLB P06746 2/20 0.32
PSMD14 O00487 1/20 0.32
MMP2 P08253 1/20 0.32
MAPT P10636 1/20 0.31
FLT3 P36888 2/20 0.31
BMX P51813 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
SCHEMBL22944764 0.93 PDE6D (0.43) PDE6DCYP1A2ALDH1A1HPGDTSHR
SCHEMBL22945667 0.92 PDE6D (0.37) PDE6DCYP1A2ALDH1A1HPGDTSHR
SCHEMBL21515253 0.91 PDE6D (0.39) PDE6DCYP1A2ALDH1A1HPGDTSHR
SCHEMBL21515237 0.88 PDE6D (0.39) PDE6DCYP1A2ALDH1A1HPGDTSHR
SCHEMBL26737300 0.88 PDE6D (0.41) PDE6DCYP1A2ALDH1A1HPGDTSHR
SCHEMBL22944882 0.88 CYP1A2 (0.35) PDE6DCYP1A2ALDH1A1HPGDTSHR
SCHEMBL22945525 0.87 PDE6D (0.41) PDE6DALDH1A1HPGDTSHRMAPK1
SCHEMBL22944763 0.85 PDE6D (0.37) PDE6DCYP1A2ALDH1A1HPGDTSHR
SCHEMBL22944883 0.84 PDE6D (0.42) PDE6DCYP1A2ALDH1A1HPGDTSHR
SCHEMBL22945528 0.83 PDE6D (0.52) PDE6DALDH1A1HPGDTSHRMAPK1

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 342/4885CYP1A2 206/4885ALDH1A1 271/4885
US-11812658-B2 Compound and organic light emitting diode comprising same DRD1, DRD3, DRD2 PDE6D 342/4885CYP1A2 206/4885ALDH1A1 271/4885

“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.