SCHEMBL24398658

SCHEMBL24398658

COCCOc1ccc(N2Cc3ccc(O)cc3OC2=O)cc1

nearest known ligand 0.62

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MIF P14174 7/20 0.62
HDAC3 O15379 1/20 0.45
HDAC1 Q13547 1/20 0.45
HDAC2 Q92769 1/20 0.45
HSD17B3 P37058 1/20 0.38
ESR2 Q92731 4/20 0.37
ESR1 P03372 3/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
DRD4 P21917 1/20 0.36
DRD5 P21918 1/20 0.36
DRD3 P35462 1/20 0.36

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
SCHEMBL24398653 0.97 MIF (0.59) MIFHDAC3HDAC1HDAC2HSD17B3
SCHEMBL26938898 0.86 MIF (0.56) MIFHDAC3HDAC1HDAC2ESR2
SCHEMBL2766991 0.86 MIF (0.74) MIFHDAC3HDAC1HDAC2HSD17B3
SCHEMBL24398656 0.85 MIF (0.54) MIFHDAC3HDAC1HDAC2ESR2
SCHEMBL24398530 0.84 MIF (0.43) MIFHDAC3HDAC1HDAC2HSD17B3
SCHEMBL26938906 0.83 ESR1 (0.55) MIFESR2ESR1
SCHEMBL29507341 0.82 MIF (0.52) MIFESR2ESR1
SCHEMBL24398654 0.82 MIF (0.52) MIFESR2ESR1
SCHEMBL26938899 0.82 ESR1 (0.50) MIFESR2ESR1
SCHEMBL2765998 0.82 MIF (0.70) MIFHDAC3HDAC1HDAC2ESR2

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-20230399303-A1 Macrophage Migration Inhibitory Factor Inhibitors, and Methods of Making and Using Same UNIV YALE (US) 2023-12-14 US disclosed
US-20230399303-A1 Macrophage Migration Inhibitory Factor Inhibitors, and Methods of Making and Using Same UNIV YALE (US) 2023-12-14 US disclosed
WO-2022093817-A1 MACROPHAGE MIGRATION INHIBITORY FACTOR INHIBITORS, AND METHODS OF MAKING AND USING SAME YALE UNIVERSITY (US) 2022-05-05 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-20230399303-A1 Macrophage Migration Inhibitory Factor Inhibitors, and Methods of Making and Using Same MIF, MMP12, METAP1 MIF 1/4885HDAC3 3212/4885HDAC1 2318/4885

“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.