SCHEMBL2728081

SCHEMBL2728081

CC(C)=CCCC(C)=CCc1c(O)cc(C)c(C=O)c1O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ DHODH Q02127 2/20 0.71
▸ MAOB P27338 6/20 0.70
▸ APP P05067 4/20 0.66
▸ PTPN1 P18031 2/20 0.66
▸ BACE1 P56817 2/20 0.66
▸ PTGES O14684 1/20 0.61
▸ ALOX5 P09917 1/20 0.61
▸ PTGS1 P23219 1/20 0.61
▸ PTGS2 P35354 1/20 0.61
▸ PPARG P37231 1/20 0.57
▸ PPARA Q07869 1/20 0.57

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
SCHEMBL21710514 1.00 DHODH (0.71) DHODHMAOBAPPPTPN1BACE1
SCHEMBL2728077 1.00 DHODH (0.71) DHODHMAOBAPPPTPN1BACE1
SCHEMBL16224871 0.99 DHODH (0.73) DHODHMAOBAPPPTPN1BACE1
SCHEMBL29378394 0.99 DHODH (0.73) DHODHMAOBAPPPTPN1BACE1
SCHEMBL31545985 0.85 MAOB (0.83) MAOBAPPPTPN1BACE1PTGES
SCHEMBL19846967 0.85 MAOB (0.83) MAOBAPPPTPN1BACE1PTGES
Piperogalin SCHEMBL24074956 0.83 MAOB (0.81) MAOBAPPPTPN1BACE1PTGES
Piperogalin SCHEMBL30086807 0.83 MAOB (0.81) MAOBAPPPTPN1BACE1PTGES
SCHEMBL23686894 0.82 DHODH (0.67) DHODHMAOBAPPPTPN1BACE1
SCHEMBL29539017 0.82 DHODH (1.00) DHODHMAOBAPPPTPN1BACE1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230095374-A1 MEROTERPENOID COMPOUNDS FOR USE IN THE PREVENTION AND TREATMENT OF A NEUROLOGICAL DISORDER GLIAPHARM SA (CH) 2023-03-30 — — US disclosed
US-20200405676-A1 MEROTERPENOID COMPOUNDS FOR USE IN THE PREVENTION AND TREATMENT OF A NEUROLOGICAL DISORDER GLIAPHARM SA (CH) 2020-12-31 — — US disclosed
EP-3681488-A1 MEROTERPENOID COMPOUNDS FOR USE IN THE PREVENTION AND TREATMENT OF A NEUROLOGICAL DISORDER Société des Produits Nestlé S.A. (CH) 2020-07-22 — — EP disclosed
WO-2019053159-A1 MEROTERPENOID COMPOUNDS FOR USE IN THE PREVENTION AND TREATMENT OF A NEUROLOGICAL DISORDER NESTEC S.A. (CH) 2019-03-21 — — WO disclosed
EP-2857010-B1 DIHYDROOROTIC ACID DEHYDROGENASE INHIBITOR INST OF MITOCHONDRIA SCIENCE INC (JP) 2018-07-04 — — EP disclosed
US-9737504-B2 Dihydroorotic and acid dehydrogenase inhibitor INSTITUTE OF MITOCHONDRIA SCIENCE, INC. (JP) 2017-08-22 — — US disclosed
US-20160296494-A1 DIHYDROOROTIC AND ACID DEHYDROGENASE INHIBITOR NAI INC. 2016-10-13 — — US disclosed
US-9440913-B2 Dihydroxybenzene derivatives and antiprotozoal agent comprising same as active ingredient NAI INC. (JP) 2016-09-13 — — US disclosed
US-20150166498-A1 DIHYDROOROTIC ACID DEHYDROGENASE INHIBITOR NAI INC. (JP) 2015-06-18 — — US disclosed
CN-104582694-A Dihydroorotic acid dehydrogenase inhibitor NAI INC 2015-04-29 — — CN disclosed
EP-2857010-A1 DIHYDROOROTIC ACID DEHYDROGENASE INHIBITOR NAI Inc. (JP) 2015-04-08 — — EP disclosed
WO-2013180140-A1 DIHYDROOROTIC ACID DEHYDROGENASE INHIBITOR エヌエーアイ株式会社 (JP) 2013-12-05 — — WO disclosed
US-20130296422-A1 Novel Dihydroxybenzene Derivatives and Antiprotozoal Agent Comprising Same as Active Ingredient ARIGEN PHARMACEUTICALS, INC. (JP) 2013-11-07 — — US disclosed
EP-2636663-A1 NOVEL DIHYDROXYBENZENE DERIVATIVES AND ANTIPROTOZOAL AGENT COMPRISING SAME AS ACTIVE INGREDIENT aRigen Pharmaceuticals, Inc. (JP) 2013-09-11 — — EP disclosed
WO-2012060387-A1 NOVEL DIHYDROXYBENZENE DERIVATIVES AND ANTIPROTOZOAL AGENT COMPRISING SAME AS ACTIVE INGREDIENT アリジェン製薬株式会社 (JP) 2012-05-10 — — 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-20150166498-A1 DIHYDROOROTIC ACID DEHYDROGENASE INHIBITOR DHODH, DPYD, DLD DHODH 1/4885MAOB 1308/4885APP 4801/4885
US-20130296422-A1 Novel Dihydroxybenzene Derivatives and Antiprotozoal Agent Comprising Same as Active Ingredient CBR3, CBR1, DHX35 DHODH 16/4885MAOB 811/4885APP 4666/4885
US-20160296494-A1 DIHYDROOROTIC AND ACID DEHYDROGENASE INHIBITOR DHODH, DPYD, DLD DHODH 1/4885MAOB 1150/4885APP 4823/4885
US-20200405676-A1 MEROTERPENOID COMPOUNDS FOR USE IN THE PREVENTION AND TREATMENT OF A NEUROLOGICAL DISORDER NLN, SLC6A13, SLC6A11 DHODH 1894/4885MAOB 700/4885APP 68/4885
US-20230095374-A1 MEROTERPENOID COMPOUNDS FOR USE IN THE PREVENTION AND TREATMENT OF A NEUROLOGICAL DISORDER NLN, SLC6A13, SLC6A11 DHODH 1894/4885MAOB 700/4885APP 68/4885

“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.

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