SCHEMBL24769832

SCHEMBL24769832

CCC(CC)(CCC(=O)O)c1csc(Nc2ccccc2OC)n1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 10/20 0.51
MAPT P10636 9/20 0.51
GAA P10253 9/20 0.51
HPGD P15428 5/20 0.51
MAPK1 P28482 2/20 0.51
MEN1 O00255 8/20 0.48
KMT2A Q03164 8/20 0.48
HTT P42858 3/20 0.47
SMN1; SMN2 Q16637 2/20 0.46
NPSR1 Q6W5P4 2/20 0.46
LMNA P02545 2/20 0.46
CFTR P13569 1/20 0.46
RAB9A P51151 2/20 0.46
NPC1 O15118 1/20 0.46
KDM4E B2RXH2 2/20 0.46
USP2 O75604 1/20 0.46
ALOX15 P16050 1/20 0.46
NFKB1 P19838 1/20 0.46
NFKB2 Q00653 1/20 0.46
RELA Q04206 1/20 0.46

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
SCHEMBL29963763 0.92 MAPT (0.51) ALDH1A1MAPTGAAHPGDMAPK1
SCHEMBL24768598 0.85 NPC1 (0.56) ALDH1A1MAPTGAAHPGDMEN1
SCHEMBL24769826 0.82 ALDH1A1 (0.52) ALDH1A1MAPTGAAHPGDMAPK1
SCHEMBL29963677 0.82 ALDH1A1 (0.52) ALDH1A1MAPTGAAHPGDMAPK1
SCHEMBL29963431 0.79 NPC1 (0.60) ALDH1A1MAPTGAAHPGDMAPK1
SCHEMBL38665488 0.77 GAA (0.70) ALDH1A1MAPTGAAMAPK1MEN1
SCHEMBL29963543 0.75 GAA (0.56) ALDH1A1MAPTGAAHPGDMAPK1
SCHEMBL29274270 0.75 MAPT (0.66) ALDH1A1MAPTGAAHPGDMAPK1
SCHEMBL24769834 0.74 GAA (0.56) ALDH1A1MAPTGAAMAPK1MEN1
SCHEMBL24769825 0.73 MEN1 (0.49) ALDH1A1MAPTGAAHPGDMAPK1

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
EP-4054608-B1 SMALL MOLECULE PROSTAGLADIN TRANSPORT INHIBITORS ALBERT EINSTEIN COLLEGE MEDICINE (US) 2026-03-04 EP disclosed
US-20220402881-A1 SMALL MOLECULE PROSTAGLADIN TRANSPORT INHIBITORS ALBERT EINSTEIN COLLEGE OF MEDICINE 2022-12-22 US disclosed
EP-4054608-A1 SMALL MOLECULE PROSTAGLADIN TRANSPORT INHIBITORS Albert Einstein College of Medicine (US) 2022-09-14 EP 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-20220402881-A1 SMALL MOLECULE PROSTAGLADIN TRANSPORT INHIBITORS PTGER1, PTGIS, PTGIR ALDH1A1 875/4885MAPT 3079/4885GAA 1226/4885

“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.