SCHEMBL8574512

SCHEMBL8574512

CCCCCCC(C(=O)O)S(=O)(=O)O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 7/20 0.53
FFAR1 O14842 2/20 0.53
MAPT P10636 1/20 0.52
LCK P06239 1/20 0.52
PPARD Q03181 1/20 0.52
ZDHHC20 Q5W0Z9 1/20 0.52
ZDHHC2 Q9UIJ5 1/20 0.52
ACE2 Q9BYF1 1/20 0.48
TP53 P04637 1/20 0.47
GRIK1 P39086 2/20 0.44
GRIK2 Q13002 2/20 0.44
FFAR4 Q5NUL3 1/20 0.44
SLC1A2 P43004 1/20 0.42
SLC1A1 P43005 1/20 0.42
CHRM1 P11229 1/20 0.41
AKR1A1 P14550 1/20 0.41
CHRM3 P20309 1/20 0.41
HTR2A P28223 1/20 0.41
HTR2C P28335 1/20 0.41
ADRA1A P35348 1/20 0.41

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
SCHEMBL27516624 1.00 GPR84 (0.53) GPR84FFAR1MAPTLCKPPARD
SCHEMBL29411296 1.00 GPR84 (0.53) GPR84FFAR1MAPTLCKPPARD
SCHEMBL8572246 1.00 GPR84 (0.53) GPR84FFAR1MAPTLCKPPARD
SCHEMBL1158129 1.00 GPR84 (0.53) GPR84FFAR1MAPTLCKPPARD
SCHEMBL3495447 1.00 GPR84 (0.53) GPR84FFAR1MAPTLCKPPARD
SCHEMBL1157909 1.00 GPR84 (0.53) GPR84FFAR1MAPTLCKPPARD
SCHEMBL3495263 1.00 GPR84 (0.53) GPR84FFAR1MAPTLCKPPARD
SCHEMBL7609463 1.00 GPR84 (0.53) GPR84FFAR1MAPTLCKPPARD
SCHEMBL9437254 1.00 GPR84 (0.53) GPR84FFAR1MAPTLCKPPARD
SCHEMBL28201959 1.00 GPR84 (0.53) GPR84FFAR1MAPTLCKPPARD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113583180-B Polyionic liquid containing thioctic acid anions and preparation method thereof 浙江理工大学龙港研究院有限公司 2023-01-10 CN disclosed
CN-115252814-A Cyclodextrin-metal organic framework composition and preparation method thereof 中国科学院上海药物研究所 2022-11-01 CN disclosed
EP-3601191-A1 HYDROPHOBIZING AGENT FOR DRY MORTAR BASF SE (DE) 2020-02-05 EP disclosed
US-9462806-B2 Use of peroxycarboxylic acids for cold aseptic filling ECOLAB USA INC. (US) 2016-10-11 US disclosed
US-20150164071-A1 USE OF PEROXYCARBOXYLIC ACIDS FOR COLD ASEPTIC FILLING ECOLAB USA INC. (US) 2015-06-18 US disclosed
WO-1998005749-A1 DETERGENT COMPOSITIONS CONTAINING DIANIONIC ESTERS THE PROCTER & GAMBLE COMPANY (US) 1998-02-12 WO disclosed
WO-1998005742-A1 LIQUID CLEANING COMPOSITIONS CONTAINING DIANIONIC ESTERS THE PROCTER & GAMBLE COMPANY (US) 1998-02-12 WO disclosed
US-5480979-A REACTING GLYCOSE WITH FATTY ALCOHOL IN PRESENCE OF ACID CATALYST, I.E., SULFOMONOCARBOXYLIC ACID, ANHYDRIDE OF SULFOMONOCARBOXYLIC ACID AND/OR MIXED CYCLIC SULFONIC ACID CARBOXYLIC ACID ANHYDRIDE HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1996-01-02 US disclosed
US-4260507-A Soap-synthetic detergent tablets LEVER BROTHERS COMPANY (US) 1981-04-07 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-20150164071-A1 USE OF PEROXYCARBOXYLIC ACIDS FOR COLD ASEPTIC FILLING HAO2, PRDX2, PRDX1 GPR84 3130/4885FFAR1 47/4885MAPT 4761/4885

“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.