SCHEMBL7092562

SCHEMBL7092562

CCCC(O)C(=O)O.CCCCC(O)C(=O)O

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 7/20 0.75
FFAR1 O14842 1/20 0.75
CA2 P00918 1/20 0.52
MAPK1 P28482 1/20 0.52
CHRM1 P11229 1/20 0.48
AKR1A1 P14550 1/20 0.48
CHRM3 P20309 1/20 0.48
HTR2A P28223 1/20 0.48
HTR2C P28335 1/20 0.48
ADRA1A P35348 1/20 0.48
HRH1 P35367 1/20 0.48
DRD3 P35462 1/20 0.48
SLC6A3 Q01959 1/20 0.48
HDAC1 Q13547 1/20 0.48
HDAC2 Q92769 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
TET2 Q6N021 3/20 0.46
KDM4A O75164 2/20 0.46
KDM4C Q9H3R0 2/20 0.46
KDM2A Q9Y2K7 2/20 0.46

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
SCHEMBL26184961 0.95 GPR84 (0.82) GPR84FFAR1CA2MAPK1CHRM1
SCHEMBL28555 0.95
SCHEMBL360108 0.95
SCHEMBL4378353 0.95
Hydrogen Peroxide SCHEMBL27840097 0.95 GPR84 (0.82) GPR84FFAR1CA2MAPK1CHRM1
SCHEMBL3783329 0.94 GPR84 (0.67) GPR84FFAR1CA2MAPK1CHRM1
SCHEMBL28425913 0.93 GPR84 (0.78) GPR84FFAR1CA2MAPK1CHRM1
Ethane SCHEMBL5400213 0.93 GPR84 (0.78) GPR84FFAR1CA2MAPK1CHRM1
SCHEMBL28800209 0.93 GPR84 (0.78) GPR84FFAR1CA2MAPK1CHRM1
SCHEMBL28848609 0.93 GPR84 (0.78) GPR84FFAR1CA2MAPK1CHRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6664287-B2 Antioxidants BETHESDA PHARMACEUTICALS, INC. 2003-12-16 US disclosed
WO-2003084532-A1 LIPOIC ACID ANALOGS USEFUL AS PROVITAMINS AND ANTIOXIDANTS AVERY MITCHELL A (US) 2003-10-16 WO disclosed
EP-1207846-A1 TOWELETTE PRODUCT UNILEVER PLC (GB) 2002-05-29 EP disclosed
US-20020048798-A1 Novel antioxidants AVERY MITCHELL ALLEN (US) 2002-04-25 US disclosed
WO-2001013880-A1 TOWELETTE PRODUCT UNILEVER PLC (GB) 2001-03-01 WO disclosed
US-5607980-A AMPHOTERIC, ANIONIC, CATIONIC SURFACTANTS AND WATER THE PROCTER & GAMBLE COMPANY (US) 1997-03-04 US 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-20020048798-A1 Novel antioxidants CUTA, LIPG, NFATC1 GPR84 2650/4885FFAR1 185/4885CA2 2907/4885

“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.