SCHEMBL517997

SCHEMBL517997

CN(C)c1ccc(-c2ccc(NC(=O)C3=C(C(=O)O)CCC3)cc2Cl)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 13/20 1.00
NPSR1 Q6W5P4 1/20 0.55
USP28 Q96RU2 1/20 0.47
NR4A2 P43354 1/20 0.46
PARP1 P09874 1/20 0.44
PARP15 Q460N3 1/20 0.44
PARP10 Q53GL7 1/20 0.44
KCNK3 O14649 1/20 0.43
NPC1 O15118 1/20 0.42
ALDH1A1 P00352 1/20 0.42
LMNA P02545 1/20 0.42
GAA P10253 1/20 0.42
MAPT P10636 1/20 0.42
MAPK1 P28482 1/20 0.42
RECQL P46063 1/20 0.42
RAB9A P51151 1/20 0.42
MCL1 Q07820 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42

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
SCHEMBL252550 0.84 DHODH (0.73) DHODHNPSR1NR4A2
SCHEMBL3915691 0.83 DHODH (0.72) DHODHNPSR1USP28MAPT
SCHEMBL20673314 0.82 DHODH (0.69) DHODHNPSR1USP28KCNK3NPC1
SCHEMBL3923655 0.82 DHODH (0.73) DHODHNPSR1NR4A2PARP1PARP15
SCHEMBL3924079 0.81 DHODH (0.72) DHODHNPSR1NR4A2FABP4FABP5
SCHEMBL244536 0.78 DHODH (0.65) DHODHNPSR1NR4A2SMN1; SMN2
SCHEMBL253533 0.78 DHODH (0.72) DHODHNPSR1NR4A2PARP1PARP15
SCHEMBL3926473 0.77 DHODH (0.67) DHODHNPSR1NR4A2PARP1PARP15
SCHEMBL13064545 0.76 DHODH (0.61) DHODHALDH1A1LMNAGAAMAPK1
SCHEMBL253865 0.75 DHODH (0.64) DHODHNPSR1NR4A2PARP1PARP15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2015154820-A1 ANTI-INFLAMMATORY AGENTS AS VIROSTATIC COMPOUNDS PANOPTES PHARMA GMBH (AT) 2015-10-15 WO claimed
US-8354433-B2 Anti-inflammatory agents as virostatic compounds 4SC AG (DE) 2013-01-15 US claimed
US-20230285355-A1 COMPOUNDS FOR TREATING OPHTHALMIC DISEASES AND DISORDERS KIORA PHARMACEUTICALS GMBH (AT) 2023-09-14 US disclosed
US-11730716-B2 Compounds for treating ophthalmic diseases and disorders KIORA PHARMACEUTICALS GMBH (AT) 2023-08-22 US disclosed
EP-3139914-B1 COMPOUNDS FOR TREATING OPHTHALMIC DISEASES AND DISORDERS KIORA PHARMACEUTICALS GMBH (DE) 2023-07-26 EP disclosed
EP-2427186-B1 DIHYDROOROTATE-DEHYDROGENASEE INHIBITORS AS VIROSTATIC COMPOUNDS PANOPTES PHARMA GES M B H (AT) 2022-01-12 EP disclosed
US-20210088520-A1 TREATMENT OF TUMORS INCORPORATING MUTANT ISOCITRATE DEHYDROGENASE SERVIER PHARMACEUTICALS LLC 2021-03-25 US disclosed
US-20190025313-A1 TREATMENT OF TUMORS INCORPORATING MUTANT ISOCITRATE DEHYDROGENASE SERVIER PHARMACEUTICALS LLC 2019-01-24 US disclosed
US-9795590-B2 Anti-inflammatory agents as virostatic compounds PANOPTES PHARMA GMBH (AT) 2017-10-24 US disclosed
US-9795590-B2 Anti-inflammatory agents as virostatic compounds PANOPTES PHARMA GMBH (AT) 2017-10-24 US disclosed
US-20170071904-A1 COMPOUNDS FOR TREATING OPHTHALMIC DISEASES AND DISORDERS KIORA PHARMACEUTICALS GMBH (AT) 2017-03-16 US disclosed
US-8354433-B2 Anti-inflammatory agents as virostatic compounds 4SC AG (DE) 2013-01-15 US disclosed
US-8354433-B2 Anti-inflammatory agents as virostatic compounds 4SC AG (DE) 2013-01-15 US disclosed
US-20120028985-A1 COMBINATIONAL THERAPY FOR TREATING AUTOIMMUNE DISEASE 4SC AG (DE) 2012-02-02 US disclosed
US-20120028985-A1 COMBINATIONAL THERAPY FOR TREATING AUTOIMMUNE DISEASE 4SC AG (DE) 2012-02-02 US disclosed
US-20120028985-A1 COMBINATIONAL THERAPY FOR TREATING AUTOIMMUNE DISEASE 4SC AG (DE) 2012-02-02 US disclosed
EP-2362771-A1 COMBINATIONAL THERAPY COMPRISING DHODH INHIBITOR AND METHOTREXATE FOR TREATING AUTOIMMUNE DISEASE 4SC AG (DE) 2011-09-07 EP disclosed
US-20100280081-A1 ANTI-INFLAMMATORY AGENTS AS VIROSTATIC COMPOUNDS 4SC AG (DE) 2010-11-04 US disclosed
US-20100280081-A1 ANTI-INFLAMMATORY AGENTS AS VIROSTATIC COMPOUNDS 4SC AG (DE) 2010-11-04 US disclosed
WO-2010052027-A1 COMBINATIONAL THERAPY COMPRISING DHODH INHIBITOR AND METHOTREXATE FOR TREATING AUTOIMMUNE DISEASE 4SC AG (DE) 2010-05-14 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 (7 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-20170071904-A1 COMPOUNDS FOR TREATING OPHTHALMIC DISEASES AND DISORDERS DHODH, ALDH1A2, QDPR DHODH 1/4885NPSR1 2838/4885USP28 2156/4885
US-20120028985-A1 COMBINATIONAL THERAPY FOR TREATING AUTOIMMUNE DISEASE HLA-DRB1, IL2, SSB DHODH 2305/4885NPSR1 2226/4885USP28 3536/4885
US-20190025313-A1 TREATMENT OF TUMORS INCORPORATING MUTANT ISOCITRATE DEHYDROGENASE DHODH, IDH1, IDH3A DHODH 1/4885NPSR1 4735/4885USP28 1541/4885
US-11730716-B2 Compounds for treating ophthalmic diseases and disorders DHODH, ALDH1A2, QDPR DHODH 1/4885NPSR1 2838/4885USP28 2156/4885
US-20210088520-A1 TREATMENT OF TUMORS INCORPORATING MUTANT ISOCITRATE DEHYDROGENASE DHODH, IDH1, IDH3A DHODH 1/4885NPSR1 4735/4885USP28 1541/4885
US-20230285355-A1 COMPOUNDS FOR TREATING OPHTHALMIC DISEASES AND DISORDERS DHODH, ALDH1A2, QDPR DHODH 1/4885NPSR1 2838/4885USP28 2156/4885
US-20100280081-A1 ANTI-INFLAMMATORY AGENTS AS VIROSTATIC COMPOUNDS TNF, MIF, IL1B DHODH 2796/4885NPSR1 2338/4885USP28 2608/4885

“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.