SCHEMBL2765855

SCHEMBL2765855

O=C1Oc2cc(O)ccc2CN1c1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MIF P14174 9/20 0.63
HDAC3 O15379 1/20 0.51
HDAC1 Q13547 1/20 0.51
HDAC2 Q92769 1/20 0.51
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
ESR1 P03372 1/20 0.39
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
HPGD P15428 2/20 0.37
CYP19A1 P11511 1/20 0.37
MAOA P21397 1/20 0.37
MAOB P27338 1/20 0.37
PSMB5 P28074 1/20 0.37
MAPT P10636 1/20 0.37
CYP2C19 P33261 1/20 0.37
HTT P42858 1/20 0.37
RECQL P46063 1/20 0.37
BLM P54132 1/20 0.37
SMAD3 P84022 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
SCHEMBL2765998 0.91 MIF (0.70) MIFHDAC3HDAC1HDAC2NPC1
SCHEMBL2766364 0.90 MIF (0.65) MIFHDAC3HDAC1HDAC2NPC1
SCHEMBL3628049 0.85 MIF (0.63) MIFHDAC3HDAC1HDAC2ESR1
SCHEMBL3625289 0.83 MIF (0.54) MIFHDAC3HDAC1HDAC2RAB9A
SCHEMBL2766991 0.82 MIF (0.74) MIFHDAC3HDAC1HDAC2NPC1
SCHEMBL24398605 0.82 MIF (0.44) MIFHDAC3HDAC1HDAC2NPC1
SCHEMBL24398684 0.82 MIF (0.54) MIFHDAC3HDAC1HDAC2NPC1
SCHEMBL2784147 0.81 NPC1 (0.51) MIFNPC1RAB9AMEN1KMT2A
SCHEMBL19985159 0.80 MIF (0.61) MIFHDAC3HDAC1HDAC2NPC1
SCHEMBL2766942 0.79 MIF (0.60) MIFHDAC3HDAC1HDAC2ESR1

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 18 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
WO-2022093817-A1 MACROPHAGE MIGRATION INHIBITORY FACTOR INHIBITORS, AND METHODS OF MAKING AND USING SAME YALE UNIVERSITY (US) 2022-05-05 WO disclosed
EP-3142665-B1 MIF INHIBITORS FOR THE ACUTE OR CHRONIC TREATMENT OF PULMONARY HYPERTENSION APAXEN (BE) 2021-01-20 EP disclosed
US-10071080-B2 MIF inhibitors for the acute or chronic treatment of pulmonary hypertension MIFCARE (FR) 2018-09-11 US disclosed
EP-2944310-B1 MIF inhibitors for the acute or chronic treatment of pulmonary hypertension MIFCARE (FR) 2018-03-21 EP disclosed
US-20170079958-A1 MIF INHIBITORS FOR THE ACUTE OR CHRONIC TREATMENT OF PULMONARY HYPERTENSION Universite Paris-Saclay (FR) 2017-03-23 US disclosed
EP-3142665-A1 MIF INHIBITORS FOR THE ACUTE OR CHRONIC TREATMENT OF PULMONARY HYPERTENSION Mifcare (FR) 2017-03-22 EP disclosed
WO-2015173433-A1 MIF INHIBITORS FOR THE ACUTE OR CHRONIC TREATMENT OF PULMONARY HYPERTENSION MIFCARE (FR) 2015-11-19 WO disclosed
EP-2944310-A1 MIF inhibitors for the acute or chronic treatment of pulmonary hypertension Mifcare (FR) 2015-11-18 EP disclosed
US-7795251-B2 3,4-dihydro-benzo[e][1,3]oxazin-2-ones NOVARTIS AG (CH) 2010-09-14 US disclosed
EP-1805170-B1 MIF-INHIBITORS NOVARTIS AG (CH) 2010-04-14 EP disclosed
US-20090156588-A1 3,4-DIHYDRO-BENZO[E][1,3]OXAZIN-2-ONES NOVARTIS AG (CH) 2009-06-18 US disclosed
US-7378416-B2 MIF-inhibitors NOVARTIS AG (CH) 2008-05-27 US disclosed
EP-1874742-A1 3,4-DIHYDRO-BENZO[E][1,3]OXAZIN-2-ONES Novartis AG (CH) 2008-01-09 EP disclosed
US-20070219189-A1 MIF-INHIBITORS NOVARTIS AG (CH) 2007-09-20 US disclosed
EP-1805170-A1 MIF-INHIBITORS Novartis AG (CH) 2007-07-11 EP disclosed
WO-2006108671-A1 3,4-DIHYDRO-BENZO[E][1,3]OXAZIN-2-ONES NOVARTIS AG (CH) 2006-10-19 WO disclosed
WO-2006045505-A1 MIF-INHIBITORS NOVARTIS AG (CH) 2006-05-04 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 (5 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-20090156588-A1 3,4-DIHYDRO-BENZO[E][1,3]OXAZIN-2-ONES CYP2C8, CYP2C18, CYP4B1 MIF 2538/4885HDAC3 166/4885HDAC1 812/4885
US-20070219189-A1 MIF-INHIBITORS MIF, FOXM1, CCR8 MIF 1/4885HDAC3 280/4885HDAC1 246/4885
US-10071080-B2 MIF inhibitors for the acute or chronic treatment of pulmonary hypertension MIF, CCL11, PGF MIF 1/4885HDAC3 1514/4885HDAC1 908/4885
US-20170079958-A1 MIF INHIBITORS FOR THE ACUTE OR CHRONIC TREATMENT OF PULMONARY HYPERTENSION MIF, CCL11, PGF MIF 1/4885HDAC3 1514/4885HDAC1 908/4885
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.