SCHEMBL24254079

SCHEMBL24254079

c1ccc(N2c3ccccc3-c3cccc4cccc(c34)-c3ccccc32)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.54
MAPK1 P28482 3/20 0.54
HSD17B10 Q99714 3/20 0.54
TSHR P16473 2/20 0.54
L3MBTL1 Q9Y468 2/20 0.54
ATM Q13315 1/20 0.54
PDE6D O43924 1/20 0.50
CES2 O00748 2/20 0.48
BCHE P06276 2/20 0.48
GAA P10253 2/20 0.48
CES1 P23141 2/20 0.48
NPSR1 Q6W5P4 1/20 0.48
CASP1 P29466 2/20 0.48
CASP7 P55210 2/20 0.48
HPGD P15428 2/20 0.48
TP53 P04637 1/20 0.48
HIF1A Q16665 1/20 0.48
MEN1 O00255 5/20 0.46
KMT2A Q03164 5/20 0.46
CYP3A4 P08684 1/20 0.44

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
SCHEMBL2329810 0.94 PDE6D (0.57) ALDH1A1MAPK1HSD17B10TSHRL3MBTL1
SCHEMBL24254012 0.84 PDE6D (0.55) ALDH1A1MAPK1HSD17B10TSHRL3MBTL1
SCHEMBL19602228 0.83 ALDH1A1 (0.59) ALDH1A1PDE6DCES2BCHEGAA
SCHEMBL12320704 0.83 ALDH1A1 (0.59) ALDH1A1PDE6DCES2BCHEGAA
SCHEMBL24254115 0.82 PDE6D (0.57) ALDH1A1MAPK1HSD17B10TSHRL3MBTL1
SCHEMBL24254003 0.82 ALDH1A1 (0.52) ALDH1A1MAPK1HSD17B10TSHRL3MBTL1
SCHEMBL16490206 0.82 ALDH1A1 (0.52) ALDH1A1MAPK1HSD17B10TSHRL3MBTL1
SCHEMBL24254086 0.81 PDE6D (0.43) ALDH1A1MAPK1HSD17B10TSHRL3MBTL1
SCHEMBL17402650 0.80 ALDH1A1 (0.57) ALDH1A1MAPK1HSD17B10TSHRL3MBTL1
SCHEMBL18859112 0.80 PDE6D (0.51) ALDH1A1MAPK1HSD17B10TSHRL3MBTL1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220052272-A1 ORGANIC ELECTROLUMINESCENT COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) 2022-02-17 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 (1 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-20220052272-A1 ORGANIC ELECTROLUMINESCENT COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME TMEM109, OR10J3, LEF1 ALDH1A1 103/4885MAPK1 482/4885HSD17B10 1741/4885

“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.