SCHEMBL4629328

SCHEMBL4629328

CCCCC(CCCO)CCC(=O)O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.48
AKR1B1 P15121 1/20 0.46
GPR84 Q9NQS5 7/20 0.45
PPARG P37231 7/20 0.45
PPARD Q03181 7/20 0.45
PPARA Q07869 7/20 0.45
HDAC11 Q96DB2 5/20 0.45
TSHR P16473 4/20 0.45
PTPN1 P18031 3/20 0.45
ALDH1A1 P00352 2/20 0.45
TLR2 O60603 2/20 0.45
TDP1 Q9NUW8 2/20 0.45
FABP4 P15090 2/20 0.45
FFAR1 O14842 2/20 0.45
FFAR4 Q5NUL3 2/20 0.45
SLC22A6 Q4U2R8 1/20 0.45
SLC22A8 Q8TCC7 1/20 0.45
MEN1 O00255 1/20 0.45
ESR1 P03372 1/20 0.45
ALOX15 P16050 1/20 0.45

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
SCHEMBL6830568 0.94 FFAR4 (0.52) AKR1B1GPR84PPARGPPARDPPARA
SCHEMBL8984375 0.92 FFAR4 (0.50) CA2GPR84PPARGPPARDPPARA
SCHEMBL3930979 0.92 CAMK2A (0.44) CA2AKR1B1GPR84PPARGPPARD
SCHEMBL4875928 0.92 CA2 (0.55) CA2AKR1B1GPR84PPARGPPARD
SCHEMBL5077959 0.91 FFAR4 (0.53) AKR1B1GPR84PPARGPPARDPPARA
Trifluoroacetic Acid SCHEMBL3342695 0.90 CA2 (0.41) CA2AKR1B1GPR84PPARGPPARD
SCHEMBL5082422 0.89 FFAR4 (0.55) AKR1B1GPR84PPARGPPARDPPARA
SCHEMBL6720816 0.88 CA2 (0.52) CA2AKR1B1GPR84PPARGPPARD
SCHEMBL28184368 0.88 FFAR4 (0.57) CA2AKR1B1GPR84PPARGPPARD
SCHEMBL10960622 0.86 FFAR4 (0.60) AKR1B1GPR84PPARGPPARDPPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008056291-A2 METHOD OF PRODUCING FATTY ACID HYDROPEROXIDES FIRMENICH SA (CH) 2008-05-15 WO disclosed
EP-1921134-A1 Method of producing fatty acid hydroperoxides Georg-August-Universität Göttingen (DE) 2008-05-14 EP disclosed
US-7179626-B1 11-Arachidonate-lipoxygenase mutants INSTITUT FUR PFLANZENBIOCHEMIE-IPB (DE) 2007-02-20 US disclosed
US-7176204-B2 Substituted carboxylic acid derivatives KYORIN PAHRMACEUTICAL CO., LTD. (JP) 2007-02-13 US disclosed
US-7018537-B2 Chiral stationary phases based on derivatives of 4-amino-3,5-dinitrobenzoic acid CHIRALLICA D.O.O. (HR) 2006-03-28 US disclosed
US-20050101521-A1 Substituted carboxylic acid derivatives KYORIN PHARMACEUTICAL CO., LTD. (JP) 2005-05-12 US disclosed
US-20040144708-A1 Chiral stationary phases based on derivatives of 4-amino-3,5-dinitrobenzoic acid EURAND PHARMACEUTICALS LTD. (IE) 2004-07-29 US disclosed
EP-1370356-A1 CHIRAL STATIONARY PHASES BASED ON DERIVATIVES OF 4-AMINO-3,5-DINITROBENZOIC ACID EURAND PHARMACEUTICALS LTD. (IE) 2003-12-17 EP disclosed
EP-1348698-A1 SUBSTITUTED CARBOXYLIC ACID DERIVATIVES Kyorin Pharmaceutical Co., Ltd. (JP) 2003-10-01 EP disclosed
WO-2002070124-A1 CHIRAL STATIONARY PHASES BASED ON DERIVATIVES OF 4-AMINO-3,5-DINITROBENZOIC ACID EURAND PHARMACEUTICALS LTD (IE) 2002-09-12 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-20050101521-A1 Substituted carboxylic acid derivatives PPARG, PPARA, PPARD CA2 1269/4885AKR1B1 290/4885GPR84 63/4885

“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.