SCHEMBL3160763

SCHEMBL3160763

Cn1c(=O)c([N+](=O)[O-])c(O)c2ccccc21

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 11/20 0.68
ALDH1A1 P00352 8/20 0.68
NPSR1 Q6W5P4 5/20 0.68
LMNA P02545 2/20 0.68
SMN1; SMN2 Q16637 2/20 0.68
NPC1 O15118 1/20 0.68
XBP1 P17861 1/20 0.68
RAB9A P51151 1/20 0.68
PAX8 Q06710 1/20 0.68
TLR9 Q9NR96 1/20 0.68
ATM Q13315 3/20 0.60
KMT2A Q03164 3/20 0.60
MEN1 O00255 2/20 0.60
NTSR1 P30989 1/20 0.59
KDM4E B2RXH2 2/20 0.58
HPGD P15428 3/20 0.56
MITF O75030 1/20 0.55
HTT P42858 1/20 0.55
GAA P10253 1/20 0.54
MAPK1 P28482 1/20 0.53

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
SCHEMBL30099697 1.00 MAPT (0.68) MAPTALDH1A1NPSR1LMNASMN1; SMN2
SCHEMBL3262089 0.81 MAPT (1.00) MAPTALDH1A1NPSR1LMNASMN1; SMN2
SCHEMBL29516939 0.81 MAPT (1.00) MAPTALDH1A1NPSR1LMNASMN1; SMN2
SCHEMBL13295325 0.81 MAPT (0.56) MAPTALDH1A1NPSR1LMNASMN1; SMN2
SCHEMBL11453080 0.79 LMNA (0.65) ALDH1A1NPSR1LMNAATMKMT2A
SCHEMBL30583271 0.78 ALDH1A1 (0.67) MAPTALDH1A1LMNASMN1; SMN2NPC1
SCHEMBL5001108 0.78 ALDH1A1 (0.67) MAPTALDH1A1LMNASMN1; SMN2NPC1
SCHEMBL11455384 0.77 MAPT (0.46) MAPTALDH1A1NPSR1LMNASMN1; SMN2
SCHEMBL11445281 0.77 MAPT (0.47) MAPTALDH1A1NPSR1LMNASMN1; SMN2
SCHEMBL30541541 0.77 FEN1 (0.50) MAPTALDH1A1NPSR1LMNASMN1; SMN2

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 63 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12600723-B2 Tetracyclic compounds as DGK inhibitors INCYTE CORPORATION (US) 2026-04-14 US disclosed
US-20240034734-A1 TETRACYCLIC COMPOUNDS AS DGK INHIBITORS INCYTE CORPORATION 2024-02-01 US disclosed
US-7732146-B2 Method for screening an agent that modulates activity of macrophage migration inhibitory factor AVANIR PHARMACEUTICALS (US) 2010-06-08 US disclosed
US-7732146-B2 Method for screening an agent that modulates activity of macrophage migration inhibitory factor AVANIR PHARMACEUTICALS (US) 2010-06-08 US disclosed
US-7732146-B2 Method for screening an agent that modulates activity of macrophage migration inhibitory factor AVANIR PHARMACEUTICALS (US) 2010-06-08 US disclosed
EP-1389110-B1 INHIBITORS OF MACROPHAGE MIGRATION INHIBITORY FACTOR AND METHODS FOR IDENTIFYING THE SAME AVANIR PHARMACEUTICALS (US) 2010-03-24 EP disclosed
EP-1389110-B1 INHIBITORS OF MACROPHAGE MIGRATION INHIBITORY FACTOR AND METHODS FOR IDENTIFYING THE SAME AVANIR PHARMACEUTICALS (US) 2010-03-24 EP disclosed
US-7678909-B1 2-[2-(3-Amino-cyclohexyl)-5-benzyl-4-oxo-4,5-dihydro-imidazo[4,5-c]pyridin-3-ylmethyl]-benzonitrile; type 2 diabetes mellitus, diabetic dislipidemia, impaired glucose tolerance; female infertility, osteoporosis, male contraception and neurological disorders TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-03-16 US disclosed
US-7514225-B2 Method for screening an agent that modulates activity of macrophage migration inhibitory factor AVANIR PHARMACEUTICALS (US) 2009-04-07 US disclosed
US-7514225-B2 Method for screening an agent that modulates activity of macrophage migration inhibitory factor AVANIR PHARMACEUTICALS (US) 2009-04-07 US disclosed
US-20060194793-A1 INHIBITORS OF MACROPHAGE MIGRATION INHIBITORY FACTOR AND METHODS FOR IDENTIFYING THE SAME AVANIR PHARMACEUTICALS 2006-08-31 US disclosed
US-20060194792-A1 Inhibitors of macrophage migration inhibitory factor and methods for identifying the same AVANIR PHARMACEUTICALS 2006-08-31 US disclosed
US-7084141-B2 Inhibitors of macrophase migration inhibitory factor and methods for identifying the same AVANIR PHARMACEUTICALS (US) 2006-08-01 US disclosed
US-20060094727-A1 INHIBITORS OF MACROPHASE MIGRATION INHIBITORY FACTOR AND METHODS FOR IDENTIFYING THE SAME AVANIR PHARMACEUTICALS 2006-05-04 US disclosed
US-20050287617-A1 Inhibitors of macrophage migration inhibitory factor and methods for identifying the same AVANIR PHARMACEUTICALS 2005-12-29 US disclosed
US-20050282236-A1 Inhibitors of macrophage migration inhibitory factor and methods for identifying the same AVANIR PHARMACEUTICALS 2005-12-22 US disclosed
EP-1389110-A2 INHIBITORS OF MACROPHAGE MIGRATION INHIBITORY FACTOR AND METHODS FOR IDENTIFYING THE SAME Avanir Pharmaceuticals (US) 2004-02-18 EP disclosed
US-20030195194-A1 Inhibitors of macrophage migration inhibitory factor and methods for identifying the same AVANIR PHARMACEUTICALS 2003-10-16 US disclosed
WO-2002094203-A2 INHIBITORS OF MACROPHAGE MIGRATION INHIBITORY FACTOR AND METHODS FOR IDENTIFYING THE SAME AVANIR PHARMACEUTICALS (US) 2002-11-28 WO disclosed
US-4192876-A ANTIALLERGENS SANDOZ, INC. (US) 1980-03-11 US 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 (6 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-20060094727-A1 INHIBITORS OF MACROPHASE MIGRATION INHIBITORY FACTOR AND METHODS FOR IDENTIFYING THE SAME MIF, MSR1, MMP12 MAPT 4790/4885ALDH1A1 1637/4885NPSR1 563/4885
US-20240034734-A1 TETRACYCLIC COMPOUNDS AS DGK INHIBITORS DGKA, DGKG, DGKI MAPT 3354/4885ALDH1A1 3928/4885NPSR1 4801/4885
US-20060194793-A1 INHIBITORS OF MACROPHAGE MIGRATION INHIBITORY FACTOR AND METHODS FOR IDENTIFYING THE SAME MIF, MSR1, MMP12 MAPT 4805/4885ALDH1A1 2081/4885NPSR1 482/4885
US-20030195194-A1 Inhibitors of macrophage migration inhibitory factor and methods for identifying the same MIF, MSR1, MMP12 MAPT 4808/4885ALDH1A1 1863/4885NPSR1 707/4885
US-12600723-B2 Tetracyclic compounds as DGK inhibitors DGKB, DGKA, NR2C2 MAPT 4860/4885ALDH1A1 3817/4885NPSR1 412/4885
US-20060194792-A1 Inhibitors of macrophage migration inhibitory factor and methods for identifying the same MIF, MSR1, MMP12 MAPT 4805/4885ALDH1A1 2081/4885NPSR1 482/4885

“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.