SCHEMBL446246

SCHEMBL446246

O=S(=O)(O)c1cc(S(=O)(=O)O)c2cc(O)ccc2c1.[NaH]

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGES O14684 1/20 0.51
NT5E P21589 3/20 0.50
CASP6 P55212 4/20 0.49
HSD17B10 Q99714 3/20 0.49
ALDH1A1 P00352 2/20 0.49
CYP2C9 P11712 1/20 0.49
CYP2C19 P33261 1/20 0.49
ENPP2 Q13822 1/20 0.47
MPL P40238 3/20 0.47
NSD2 O96028 4/20 0.46
LMNA P02545 2/20 0.45
PTPN11 Q06124 3/20 0.43
DUSP3 P51452 2/20 0.43
PTPN5 P54829 2/20 0.43
CASP7 P55210 1/20 0.43
MAPK1 P28482 1/20 0.41
SUMO2 P61956 1/20 0.40
SUMO1 P63165 1/20 0.40
SENP7 Q9BQF6 1/20 0.40
SENP2 Q9HC62 1/20 0.40

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
SCHEMBL18274861 1.00 PTGES (0.51) PTGESNT5ECASP6HSD17B10ALDH1A1
SCHEMBL29364155 0.98 PTGES (0.52) PTGESNT5ECASP6HSD17B10ALDH1A1
SCHEMBL18274862 0.98 PTGES (0.52) PTGESNT5ECASP6HSD17B10ALDH1A1
SCHEMBL118229 0.98 PTGES (0.52) PTGESNT5ECASP6HSD17B10ALDH1A1
SCHEMBL31255685 0.98 PTGES (0.52) PTGESNT5ECASP6HSD17B10ALDH1A1
Sulfuric Acid SCHEMBL8333659 0.96 PTGES (0.51) PTGESNT5ECASP6HSD17B10ALDH1A1
SCHEMBL9179236 0.96 PTGES (0.51) PTGESNT5ECASP6HSD17B10ALDH1A1
Ammonia Solution, Strong SCHEMBL28460415 0.96 PTGES (0.51) PTGESNT5ECASP6HSD17B10ALDH1A1
SCHEMBL30687388 0.96 PTGES (0.51) PTGESNT5ECASP6HSD17B10ALDH1A1
SCHEMBL5036935 0.96 PTGES (0.51) PTGESNT5ECASP6HSD17B10ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11752086-B2 Topical formulations and methods MYOCEPT INC. (US) 2023-09-12 US disclosed
CN-111182884-B Inorganic sunscreen coated with adducts of hydroxycinnamic esters and silanols 维佐尔有限责任公司 2023-01-31 CN disclosed
CN-115594987-A Acid orange disazo dye and preparation method thereof 金华恒利康化工有限公司(CN) 2023-01-13 CN disclosed
CN-112341836-B Weak acid red bisazo dye and preparation method thereof 金华恒利康化工有限公司 2021-09-21 CN disclosed
CN-112341836-A Weak acid red bisazo dye and preparation method thereof 金华恒利康化工有限公司 2021-02-09 CN disclosed
CN-110612093-A Topical formulations and methods 麦欧赛普特股份有限公司 2019-12-24 CN disclosed
WO-2018148338-A1 TOPICAL FORMULATIONS AND METHODS PETERS LARS ERIK (US) 2018-08-16 WO disclosed
US-20170105967-A1 COMPOSITIONS AND METHODS OF TREATMENT OF INFLAMMATORY SKIN CONDITIONS USING ALLANTOIN SCIODERM, INC. (US) 2017-04-20 US disclosed
US-20170105968-A1 Compositions and Methods for Treatment of Inflammatory Skin Conditions Using Allantoin SCIODERM, INC. (US) 2017-04-20 US disclosed
US-20170049749-A1 METHODS FOR TREATING BURNS USING ALLANTOIN Scioderm.Inc. (US) 2017-02-23 US disclosed
US-20060045926-A1 Methods and compositions for enhancing collagen and proteoglycan synthesis in the skin NIMNI MARCEL 2006-03-02 US disclosed
US-20030157137-A1 Emulsified skin care composition containing salicylic acid, lanolin oil, and propylene glycol ALWYN COMPANY, INC. 2003-08-21 US disclosed
US-20030147968-A1 Allantoin-containing preparations for administration as gels and aerosols ALWYN COMPANY, INC. 2003-08-07 US disclosed
WO-2003053369-A1 ALLANTOIN-CONTAINING PREPARATIONS FOR ADMINISTRATION AS GELS AND AEROSOLS ALWYN COMPANY, INC. (US) 2003-07-03 WO disclosed
WO-2003041688-A1 METHODS FOR TREATMENT OF INFLAMMATORY DISEASES ALWYN COMPANY, INC. (US) 2003-05-22 WO disclosed
WO-2003041651-A2 ALLATOIN-CONTAINING SKIN CREAM ALWYN COMPANY, INC. (US) 2003-05-22 WO disclosed
US-20020054895-A1 And at least one anionic or nonionic emulsifier that is substantially hydrophilic and is soluble in water; skin protectants ALWYN COMPANY, INC. 2002-05-09 US disclosed
US-20020055531-A1 Methods for treatment of inflammatory diseases SWEEN, MAURICE ALWYN 2002-05-09 US disclosed
US-6376557-B1 TRANSDERMAL SUPPLYING ZAVERI CHANDA BHUWALKA (US) 2002-04-23 US disclosed
WO-2001068107-A1 HAIR RESTORATION FORMULATION ZAVERI CHANDA BHUWALKA (US) 2001-09-20 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 (5 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-20170049749-A1 METHODS FOR TREATING BURNS USING ALLANTOIN ALKBH1, ALKBH3, FAAH2 PTGES 148/4885NT5E 621/4885CASP6 459/4885
US-20060045926-A1 Methods and compositions for enhancing collagen and proteoglycan synthesis in the skin COL1A1, COL14A1, COL2A1 PTGES 177/4885NT5E 3463/4885CASP6 2567/4885
US-20170105967-A1 COMPOSITIONS AND METHODS OF TREATMENT OF INFLAMMATORY SKIN CONDITIONS USING ALLANTOIN CUTA, ITCH, ARG1 PTGES 180/4885NT5E 4824/4885CASP6 904/4885
US-20170105968-A1 Compositions and Methods for Treatment of Inflammatory Skin Conditions Using Allantoin CUTA, ITCH, ARG1 PTGES 191/4885NT5E 4831/4885CASP6 917/4885
US-11752086-B2 Topical formulations and methods KRT18, ANXA3, VIP PTGES 2463/4885NT5E 2813/4885CASP6 1919/4885

“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.