SCHEMBL25596019

SCHEMBL25596019

c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-c4cc5ccccc5cc4-c4ccc5c6c(cccc46)-c4cc6ccccc6cc4-5)cc3)n2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.46
HPGD P15428 6/20 0.46
TSHR P16473 4/20 0.46
HSD17B10 Q99714 4/20 0.46
MAPK1 P28482 3/20 0.46
TP53 P04637 3/20 0.46
CASP1 P29466 2/20 0.46
HIF1A Q16665 2/20 0.46
CASP7 P55210 1/20 0.46
L3MBTL1 Q9Y468 3/20 0.45
MAPT P10636 4/20 0.41
KDM4E B2RXH2 4/20 0.41
ATM Q13315 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
NFKB1 P19838 1/20 0.41
NFKB2 Q00653 1/20 0.41
RELA Q04206 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
PTGS2 P35354 1/20 0.40
MEN1 O00255 6/20 0.39

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
SCHEMBL25595938 0.98 ALDH1A1 (0.47) ALDH1A1HPGDTSHRHSD17B10MAPK1
SCHEMBL25595936 0.94 ALDH1A1 (0.49) ALDH1A1HPGDTSHRHSD17B10MAPK1
SCHEMBL25595951 0.93 ALDH1A1 (0.47) ALDH1A1HPGDTSHRHSD17B10MAPK1
SCHEMBL25595953 0.93 ALDH1A1 (0.47) ALDH1A1HPGDTSHRHSD17B10MAPK1
SCHEMBL25595964 0.92 ALDH1A1 (0.50) ALDH1A1HPGDTSHRHSD17B10MAPK1
SCHEMBL25595942 0.92 HPGD (0.45) ALDH1A1HPGDTSHRHSD17B10MAPK1
SCHEMBL25595946 0.92 HPGD (0.45) ALDH1A1HPGDTSHRHSD17B10MAPK1
SCHEMBL25595937 0.91 ALDH1A1 (0.46) ALDH1A1HPGDTSHRHSD17B10MAPK1
SCHEMBL25595965 0.91 ALDH1A1 (0.46) ALDH1A1HPGDTSHRHSD17B10MAPK1
SCHEMBL17692184 0.91 ALDH1A1 (0.48) ALDH1A1HPGDTSHRHSD17B10MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230165140-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME LG CHEM, LTD. (KR) 2023-05-25 US disclosed
US-20230165140-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME LG CHEM, LTD. (KR) 2023-05-25 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-20230165140-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME CRY1, TMEM109, TRPA1 ALDH1A1 29/4885HPGD 2584/4885TSHR 4824/4885

“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.