SCHEMBL17128798

SCHEMBL17128798

CC(C)(C)c1ccccc1-c1cc2ccc(O)cc2c(=O)o1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 4/20 0.42
▸ KMT2A Q03164 4/20 0.42
▸ TDP1 Q9NUW8 2/20 0.42
▸ HPGD P15428 4/20 0.41
▸ CYP3A4 P08684 2/20 0.41
▸ CYP2C19 P33261 2/20 0.41
▸ ALDH1A1 P00352 2/20 0.41
▸ TSHR P16473 1/20 0.41
▸ ALOX5 P09917 2/20 0.40
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ TP53 P04637 1/20 0.39
▸ ALOX15 P16050 1/20 0.39
▸ PTGES O14684 3/20 0.39
▸ MIF P14174 3/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.38
▸ RXFP1 Q9HBX9 1/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ CYP19A1 P11511 1/20 0.38
▸ KDM4E B2RXH2 2/20 0.37
▸ P2RY1 P47900 1/20 0.37

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
SCHEMBL17128792 0.87 C1R (0.47) MEN1KMT2ATDP1HPGDALDH1A1
SCHEMBL17114051 0.82 HPGD (0.48) MEN1KMT2ATDP1HPGDCYP3A4
SCHEMBL17128800 0.81 MEN1 (0.40) MEN1KMT2ATDP1HPGDCYP3A4
SCHEMBL17128883 0.80 NOTUM (0.43) MEN1KMT2ATDP1HPGDCYP3A4
SCHEMBL17128804 0.80 MEN1 (0.43) MEN1KMT2ATDP1HPGDCYP3A4
SCHEMBL17128801 0.80 MEN1 (0.43) MEN1KMT2ATDP1HPGDCYP3A4
SCHEMBL17128884 0.79 TRPV1 (0.41) MEN1KMT2ATDP1HPGDALOX5
SCHEMBL17128870 0.77 HSD17B3 (0.42) MEN1KMT2ATDP1HPGDCYP3A4
SCHEMBL20953941 0.77 MEN1 (0.51) MEN1KMT2ATDP1HPGDCYP3A4
SCHEMBL17128806 0.77 MEN1 (0.41) MEN1KMT2ATDP1HPGDCYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3122735-B1 3-PHENYL-7-HYDROXY-ISOCOUMARINS AS MACROPHAGE MIGRATION INHIBITORY FACTOR (MIF) INHIBITORS THE PROVOST FELLOWS FOUND SCHOLARS AND THE OTHER MEMBERS OF BOARD OF THE COLLEGE OF THE HOLY & UNDIV (IE) 2019-05-08 — — EP disclosed
US-20190071410-A1 3-Phenyl-7-Hydroxy-Isocoumarins as Macrophage Migration Inhibitory Factor (MIF) Inhibitors THE PROVOST, FELLOWS, FOUNDATION SCHOLARS, AND THE OTHER MEMBERS OF BOARD, OF THE COLLEGE OF THE HOLY AND UNDIVIDED TRINITY OF QUEEN ELIZABETH, NEAR DUBLIN (IE) 2019-03-07 — — US disclosed
US-20170144983-A1 3-Phenyl-7-Hydroxy-Isocoumarins as Macrophage Migration Inhibitory Factor (MIF) Inhibitors THE PROVOST, FELLOWS, FOUNDATION SCHOLARS, AND THE OTHER MEMBERS OF BOARD, OF THE COLLEGE OF THE HOLY AND UNDIVIDED TRINITY OF QUEEN ELIZABETH, NEAR DUBLIN (IE) 2017-05-25 — — US disclosed
US-20170144983-A1 3-Phenyl-7-Hydroxy-Isocoumarins as Macrophage Migration Inhibitory Factor (MIF) Inhibitors THE PROVOST, FELLOWS, FOUNDATION SCHOLARS, AND THE OTHER MEMBERS OF BOARD, OF THE COLLEGE OF THE HOLY AND UNDIVIDED TRINITY OF QUEEN ELIZABETH, NEAR DUBLIN (IE) 2017-05-25 — — US disclosed
WO-2015144911-A1 3-PHENYL-7-HYDROXY-ISOCOUMARINS AS MACROPHAGE MIGRATION INHIBITORY FACTOR (MIF) INHIBITORS THE PROVOST, FELLOWS, FOUNDATION SCHOLARS, AND THE OTHER MEMBERS OF BOARD, OF THE COLLEGE OF THE HOLY AND UNDIVIDED TRINITY OF QUEEN ELIZABETH, NEAR DUBLIN (IE) 2015-10-01 — — 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 (2 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-20170144983-A1 3-Phenyl-7-Hydroxy-Isocoumarins as Macrophage Migration Inhibitory Factor (MIF) Inhibitors MIF, CCL2, MMP12 MEN1 3024/4885KMT2A 3410/4885TDP1 4472/4885
US-20190071410-A1 3-Phenyl-7-Hydroxy-Isocoumarins as Macrophage Migration Inhibitory Factor (MIF) Inhibitors MIF, CCL2, MMP12 MEN1 3024/4885KMT2A 3410/4885TDP1 4472/4885

“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.

Send feedback