SCHEMBL5064990

SCHEMBL5064990

O=C(O)C1=C(O)C(O)=CCC1

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.33
SLC6A1 P30531 1/20 0.33
SLC6A13 Q9NSD5 1/20 0.33
ACMSD Q8TDX5 2/20 0.33
BLM P54132 1/20 0.32

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
SCHEMBL10823560 0.72 PYGM (0.31)
SCHEMBL171057 0.67
Bicarbonate SCHEMBL5672748 0.66 CA1 (0.33) TSHRSLC6A1SLC6A13BLM
SCHEMBL22290 0.64
SCHEMBL17503288 0.64
SCHEMBL19380597 0.64
SCHEMBL7184654 0.64 PYGM (0.32)
SCHEMBL21076548 0.64 TSHR (0.32) TSHRSLC6A1SLC6A13BLM
SCHEMBL3911165 0.63 PTPN22 (0.34) TSHR
SCHEMBL7430520 0.63 KDM4E (0.31)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1313870-B8 METHOD FOR THE IMPROVED PRODUCTION AND ISOLATION OF TRANS-DIHYDROXYCYCLOHEXADIENE CARBOXYLIC ACIDS AND/OR DERIVATIVES THEREOF AND A GENETICALLY MODIFIED ORGANISM SUITABLE FOR THE ABOVE FORSCHUNGSZENTRUM JUELICH GMBH (DE) 2006-01-11 EP claimed
US-20050227333-A1 Process for the production of an aromatic amino acid metabolite or derivative thereof DSM IP ASSETS B.V. (NL) 2005-10-13 US claimed
EP-1313870-B1 METHOD FOR THE IMPROVED PRODUCTION AND ISOLATION OF TRANS-DIHYDROXYCYCLOHEXADIENE CARBOXYLIC ACIDS AND/OR DERIVATIVES THEREOF AND A GENETICALLY MODIFIED ORGANISM SUITABLE FOR THE ABOVE FORSCHUNGSZENTRUM JUELICH GMBH (DE) 2005-09-21 EP claimed
US-20030224495-A1 Method for the improved production and isolation of trans-dihydroxycyclohexadiene carboxylic acids and/or derivatives thereof and genetically modified organism suitable therefor DSM BIOTECH GMBH (DE) 2003-12-04 US claimed
EP-1313870-A2 METHOD FOR THE IMPROVED PRODUCTION AND ISOLATION OF TRANS-DIHYDROXYCYCLOHEXADIENE CARBOXYLIC ACIDS AND/OR DERIVATIVES THEREOF AND A GENETICALLY MODIFIED ORGANISM SUITABLE FOR THE ABOVE Forschungszentrum Jülich (DE) 2003-05-28 EP claimed
WO-2002018611-A2 METHOD FOR THE IMPROVED PRODUCTION AND ISOLATION OF TRANS-DIHYDROXYCYCLOHEXADIENE CARBOXYLIC ACIDS AND/OR DERIVATIVES THEREOF AND A GENETICALLY MODIFIED ORGANISM SUITABLE FOR THE ABOVE Forschungszentrum Jülich GmbH (DE) 2002-03-07 WO claimed
US-20080311631-A1 Biosynthetic Production of 4-Amino 4-Deoxychorismate (Adc) and [3R,4R]-4-Amino-3-Hydroxycyclohexa-1,5-Diene-1-Carboxylic Acid (3,4-Cha) DSM IP ASSETS B. V. (NL) 2008-12-18 US disclosed
EP-1751297-A2 BIOSYNTHETIC PRODUCTION OF 4-AMINO-4-DEOXYCHORISMATE (ADC) AND [3,4R]-4-AMINO-3-HYDROXYCYCLOHEXA-1,5-DIENE-1-CARBOXYLIC ACID (3,4-CHA) DSMIP Assets B.V. (NL) 2007-02-14 EP disclosed
WO-2005118829-A3 BIOSYNTHETIC PRODUCTION OF 4-AMINO-4-DEOXYCHORISMATE (ADC) AND [3R,4R]-4-AMINO-3-HYDROXYCYCLOHEXA-1,5-DIENE-1-CARBOXYLIC ACID (3,4-CHA) DSM IP ASSETS BV (NL) 2006-06-15 WO disclosed
EP-1313870-B8 METHOD FOR THE IMPROVED PRODUCTION AND ISOLATION OF TRANS-DIHYDROXYCYCLOHEXADIENE CARBOXYLIC ACIDS AND/OR DERIVATIVES THEREOF AND A GENETICALLY MODIFIED ORGANISM SUITABLE FOR THE ABOVE FORSCHUNGSZENTRUM JUELICH GMBH (DE) 2006-01-11 EP disclosed
EP-1313870-B8 METHOD FOR THE IMPROVED PRODUCTION AND ISOLATION OF TRANS-DIHYDROXYCYCLOHEXADIENE CARBOXYLIC ACIDS AND/OR DERIVATIVES THEREOF AND A GENETICALLY MODIFIED ORGANISM SUITABLE FOR THE ABOVE FORSCHUNGSZENTRUM JUELICH GMBH (DE) 2006-01-11 EP disclosed
WO-2005118829-A2 BIOSYNTHETIC PRODUCTION OF 4-AMINO-4-DEOXYCHORISMATE (ADC) AND [3R,4R]-4-AMINO-3-HYDROXYCYCLOHEXA-1,5-DIENE-1-CARBOXYLIC ACID (3,4-CHA) DSM IP ASSETS B.V. (NL) 2005-12-15 WO disclosed
EP-1313870-B1 METHOD FOR THE IMPROVED PRODUCTION AND ISOLATION OF TRANS-DIHYDROXYCYCLOHEXADIENE CARBOXYLIC ACIDS AND/OR DERIVATIVES THEREOF AND A GENETICALLY MODIFIED ORGANISM SUITABLE FOR THE ABOVE FORSCHUNGSZENTRUM JUELICH GMBH (DE) 2005-09-21 EP disclosed
US-20030224495-A1 Method for the improved production and isolation of trans-dihydroxycyclohexadiene carboxylic acids and/or derivatives thereof and genetically modified organism suitable therefor DSM BIOTECH GMBH (DE) 2003-12-04 US disclosed
US-20030224495-A1 Method for the improved production and isolation of trans-dihydroxycyclohexadiene carboxylic acids and/or derivatives thereof and genetically modified organism suitable therefor DSM BIOTECH GMBH (DE) 2003-12-04 US disclosed
EP-1313870-A2 METHOD FOR THE IMPROVED PRODUCTION AND ISOLATION OF TRANS-DIHYDROXYCYCLOHEXADIENE CARBOXYLIC ACIDS AND/OR DERIVATIVES THEREOF AND A GENETICALLY MODIFIED ORGANISM SUITABLE FOR THE ABOVE Forschungszentrum Jülich (DE) 2003-05-28 EP disclosed
EP-1313870-A2 METHOD FOR THE IMPROVED PRODUCTION AND ISOLATION OF TRANS-DIHYDROXYCYCLOHEXADIENE CARBOXYLIC ACIDS AND/OR DERIVATIVES THEREOF AND A GENETICALLY MODIFIED ORGANISM SUITABLE FOR THE ABOVE Forschungszentrum Jülich (DE) 2003-05-28 EP disclosed
WO-2002018611-A3 METHOD FOR THE IMPROVED PRODUCTION AND ISOLATION OF TRANS-DIHYDROXYCYCLOHEXADIENE CARBOXYLIC ACIDS AND/OR DERIVATIVES THEREOF AND A GENETICALLY MODIFIED ORGANISM SUITABLE FOR THE ABOVE FORSCHUNGSZENTRUM JUELICH GMBH (DE) 2002-10-03 WO disclosed
WO-2002018611-A2 METHOD FOR THE IMPROVED PRODUCTION AND ISOLATION OF TRANS-DIHYDROXYCYCLOHEXADIENE CARBOXYLIC ACIDS AND/OR DERIVATIVES THEREOF AND A GENETICALLY MODIFIED ORGANISM SUITABLE FOR THE ABOVE Forschungszentrum Jülich GmbH (DE) 2002-03-07 WO disclosed
WO-2002018611-A2 METHOD FOR THE IMPROVED PRODUCTION AND ISOLATION OF TRANS-DIHYDROXYCYCLOHEXADIENE CARBOXYLIC ACIDS AND/OR DERIVATIVES THEREOF AND A GENETICALLY MODIFIED ORGANISM SUITABLE FOR THE ABOVE Forschungszentrum Jülich GmbH (DE) 2002-03-07 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 (1 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-20080311631-A1 Biosynthetic Production of 4-Amino 4-Deoxychorismate (Adc) and [3R,4R]-4-Amino-3-Hydroxycyclohexa-1,5-Diene-1-Carboxylic Acid (3,4-Cha) HPD, DHPS, PGD TSHR 2974/4885SLC6A1 3262/4885SLC6A13 3596/4885

“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.