SCHEMBL2533774

SCHEMBL2533774

CC1(C(=O)O)C(C(=O)O)CCC1C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC1A2 P43004 1/20 0.41
SLC1A1 P43005 1/20 0.41
CYP2C19 P33261 4/20 0.39
MAPK1 P28482 2/20 0.39
LMNA P02545 2/20 0.39
MTOR P42345 2/20 0.39
TP53 P04637 1/20 0.39
NFKB1 P19838 1/20 0.39
THPO P40225 1/20 0.39
STAT6 P42226 1/20 0.39
HIF1A Q16665 1/20 0.39
NPC1 O15118 1/20 0.39
GMNN O75496 1/20 0.39
RAB9A P51151 1/20 0.39
BLM P54132 1/20 0.39
PMP22 Q01453 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
APLNR P35414 1/20 0.39
FFAR3 O14843 1/20 0.38

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
SCHEMBL25117220 0.78 SLC1A2 (0.43) SLC1A2SLC1A1CYP2C19MAPK1LMNA
SCHEMBL23662945 0.78 SLC1A2 (0.43) SLC1A2SLC1A1CYP2C19MAPK1LMNA
SCHEMBL19066956 0.74 ALDH1A1 (0.32) SLC1A2SLC1A1ALDH1A1
SCHEMBL5428847 0.72 MAPK1 (0.42) SLC1A2SLC1A1CYP2C19MAPK1LMNA
SCHEMBL10108095 0.72
SCHEMBL11499511 0.70 SLC1A2 (0.47) SLC1A2SLC1A1CYP2C19MAPK1LMNA
SCHEMBL15746998 0.70 HSD11B1 (0.41) SLC1A2SLC1A1CYP2C19MAPK1LMNA
SCHEMBL14389636 0.70 HSD11B1 (0.41) SLC1A2SLC1A1CYP2C19MAPK1LMNA
SCHEMBL1108298 0.70 HSD11B1 (0.41) SLC1A2SLC1A1CYP2C19MAPK1LMNA
SCHEMBL2897770 0.69

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-2398758-A1 REACTIVE EXTRACTION OF FREE ORGANIC ACIDS FROM AMMONIUM SALTS THEREOF Evonik Degussa GmbH (DE) 2011-12-28 EP claimed
WO-2010094630-A1 REACTIVE EXTRACTION OF FREE ORGANIC ACIDS FROM AMMONIUM SALTS THEREOF EVONIK DEGUSSA GMBH (DE) 2010-08-26 WO claimed
US-20100210871-A1 Reactive Extraction of Free Organic Acids from the Ammonium Salts Thereof EVONIK DEGUSSA GMBH (DE) 2010-08-19 US claimed
US-8809576-B2 Method for producing a free acid from the salt thereof EVONIK DEGUSSA GMBH (DE) 2014-08-19 US disclosed
CN-102325746-A Reactive Extraction of Free Organic Acids from Ammonium Salts of Organic Acids EVONIK DEGUSSA GMBH 2012-01-18 CN disclosed
EP-2398758-A1 REACTIVE EXTRACTION OF FREE ORGANIC ACIDS FROM AMMONIUM SALTS THEREOF Evonik Degussa GmbH (DE) 2011-12-28 EP disclosed
CN-102272086-A Method for producing a free acid from the salt thereof 2011-12-07 CN disclosed
US-20110257429-A1 METHOD FOR PRODUCING A FREE ACID FROM THE SALT THEREOF EVONIK DEGUSSA GMBH (DE) 2011-10-20 US disclosed
WO-2010094630-A1 REACTIVE EXTRACTION OF FREE ORGANIC ACIDS FROM AMMONIUM SALTS THEREOF EVONIK DEGUSSA GMBH (DE) 2010-08-26 WO disclosed
US-20100210871-A1 Reactive Extraction of Free Organic Acids from the Ammonium Salts Thereof EVONIK DEGUSSA GMBH (DE) 2010-08-19 US disclosed
EP-0504660-B1 Liquid crystal compounds BASF AG (DE) 1998-08-19 EP disclosed
US-5549853-A Linked azo dyes BASF AKTIENGESELLSCHAFT (DE) 1996-08-27 US disclosed
US-5455325-A Optically active phenoxypropionic esters BASF AKTIENGESELLSCHAFT (DE) 1995-10-03 US disclosed
US-5417882-A Data carriers and display elements BASF AKTIENGESELLSCHAFT (DE) 1995-05-23 US disclosed
US-5417884-A Containing a thiadiazole group BASF AKTIENGESELLSCHAFT (DE) 1995-05-23 US disclosed
EP-0630945-A1 Use of reticulated azo dyes in non-linear optics BASF Aktiengesellschaft (DE) 1994-12-28 EP disclosed
US-5350873-A Optically active phenoxypropionic esters BASF AKTIENGESELLSCHAFT (DE) 1994-09-27 US disclosed
EP-0583605-A1 Defined oligomeric liquid crystalline compounds with smectic liquid crystalline phases BASF Aktiengesellschaft (DE) 1994-02-23 EP disclosed
EP-0528268-A2 Optically active esters of phenoxypropionic acid BASF Aktiengesellschaft (DE) 1993-02-24 EP disclosed
EP-0504660-A2 Liquid crystal compounds BASF Aktiengesellschaft (DE) 1992-09-23 EP 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 (2 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-20110257429-A1 METHOD FOR PRODUCING A FREE ACID FROM THE SALT THEREOF FFAR1, SLC9B2, FFAR2 SLC1A2 369/4885SLC1A1 411/4885CYP2C19 2213/4885
US-20100210871-A1 Reactive Extraction of Free Organic Acids from the Ammonium Salts Thereof CA2, HCN2, CA9 SLC1A2 321/4885SLC1A1 592/4885CYP2C19 2267/4885

“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.