SCHEMBL7033003

SCHEMBL7033003

COC(=O)c1cc(-c2cccc(NC(C)=O)c2)ccc1NC(=O)c1ccc2ccccc2c1

nearest known ligand 0.59

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PLAU P00749 9/20 0.59
ALDH1A1 P00352 2/20 0.59
MAPT P10636 1/20 0.59
HTT P42858 1/20 0.59
KMT2A Q03164 3/20 0.53
MEN1 O00255 2/20 0.53
NPC1 O15118 1/20 0.53
RAB9A P51151 1/20 0.53
SIRT2 Q8IXJ6 1/20 0.52
KDM4E B2RXH2 1/20 0.51
ALOX12 P18054 1/20 0.51
PLAT P00750 3/20 0.49
PLG P00747 2/20 0.49
RXFP1 Q9HBX9 1/20 0.48
ADORA3 P0DMS8 1/20 0.48
PPARG P37231 1/20 0.48
PPARD Q03181 1/20 0.48
PPARA Q07869 1/20 0.48
NR1H4 Q96RI1 1/20 0.48

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
SCHEMBL7039689 0.89 MAPT (0.55) PLAUALDH1A1MAPTHTTKMT2A
Lithium Ion SCHEMBL7036038 0.88 ALDH1A1 (0.53) PLAUALDH1A1MAPTHTTKMT2A
SCHEMBL7038894 0.83 PLAU (0.56) PLAUALDH1A1MAPTNPC1RAB9A
SCHEMBL7041709 0.80 PLAU (0.52) PLAUALDH1A1MAPTHTTKMT2A
SCHEMBL19554242 0.80 KDM4E (0.61) PLAUALDH1A1MAPTHTTKMT2A
SCHEMBL7230026 0.79 SIRT2 (0.72) PLAUALDH1A1MAPTKMT2AMEN1
SCHEMBL21446855 0.78 KDM4E (0.77) ALDH1A1MAPTKMT2AMEN1NPC1
SCHEMBL14384814 0.78 HSD17B1 (0.69) ALDH1A1MAPTKMT2AMEN1NPC1
SCHEMBL7038439 0.77 PPARG (0.55) ALDH1A1MAPTHTTKMT2AMEN1
SCHEMBL19554308 0.75 KDM4E (0.56) PLAUALDH1A1MAPTHTTKMT2A

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-20030073862-A1 Compounds BIOVITRUM AB (SE) 2003-04-17 US disclosed
WO-2003004458-A1 NEW COMPOUNDS BIOVITRUM AB (SE) 2003-01-16 WO 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-20030073862-A1 Compounds PPARG, PPARA, PPARD PLAU 3230/4885ALDH1A1 383/4885MAPT 4479/4885

“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.