SCHEMBL39033

SCHEMBL39033

CCCc1c(O)cc(O)cc1C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 4/20 0.54
PTPN11 Q06124 3/20 0.54
KAT8 Q9H7Z6 2/20 0.45
MCL1 Q07820 1/20 0.45
PPARA Q07869 1/20 0.45
PTPN2 P17706 2/20 0.43
PGAM1 P18669 1/20 0.43
CA12 O43570 2/20 0.42
CA1 P00915 2/20 0.42
CA2 P00918 2/20 0.42
CA7 P43166 2/20 0.42
CA9 Q16790 2/20 0.42
CA14 Q9ULX7 2/20 0.42
ALOX5 P09917 1/20 0.42
PTGS2 P35354 1/20 0.42
ALDH1A1 P00352 1/20 0.42
TSHR P16473 1/20 0.42
LDHA P00338 2/20 0.41
LDHB P07195 2/20 0.41
CYP3A4 P08684 2/20 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
SCHEMBL39571 0.89 KAT8 (0.50) PTPN1PTPN11KAT8PPARACYP3A4
Grevillol SCHEMBL31345744 0.86 KAT8 (0.59) PTPN1PTPN11KAT8MCL1PPARA
SCHEMBL39025 0.85 CA12 (0.45) PTPN1PTPN11KAT8PPARAPTPN2
SCHEMBL19433113 0.81 CA12 (0.50) PTPN1PTPN11PTPN2CA12CA1
SCHEMBL15537699 0.81 PTPN1 (0.42) PTPN1PTPN11PTPN2PGAM1CA12
SCHEMBL6832976 0.80 HTT (0.52) PTPN1PTPN11PGAM1ALOX5PTGS2
SCHEMBL22660353 0.79 CA12 (0.40) PTPN1PTPN11KAT8PPARACA12
SCHEMBL22629 0.78 LDHA (0.49) PTPN1PTPN11KAT8MCL1PPARA
SCHEMBL27639352 0.78 LDHA (0.49) PTPN1PTPN11KAT8MCL1PPARA
SCHEMBL3392969 0.77 CA2 (0.45) PTPN1PTPN11CA12CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11129781-B2 Agent for hair deforming treatment KAO CORPORATION (JP) 2021-09-28 US disclosed
US-11045402-B2 Hair cosmetic composition KAO CORPORATION (JP) 2021-06-29 US disclosed
US-10959925-B2 Hair cosmetic composition KAO CORPORATION (JP) 2021-03-30 US disclosed
EP-3228302-B1 HAIR DEFORMATION TREATMENT AGENT KAO CORP (JP) 2020-09-02 EP disclosed
CN-106999382-B Hair deforming agent 花王株式会社 2020-07-10 CN disclosed
CN-106999380-B Hair deforming agent 花王株式会社 2020-05-05 CN disclosed
US-20190290564-A1 HAIR COSMETIC COMPOSITION KAO CORPORATION (JP) 2019-09-26 US disclosed
US-20190254943-A1 HAIR COSMETIC COMPOSITION KAO CORPORATION (JP) 2019-08-22 US disclosed
US-20190224093-A1 HAIR COSMETIC COMPOSITION KAO CORPORATION (JP) 2019-07-25 US disclosed
US-20190125052-A1 METHOD FOR TREATING HAIR KAO CORPORATION (JP) 2019-05-02 US disclosed
US-20180353406-A1 AGENT FOR HAIR DEFORMING TREATMENT KAO CORPORATION (JP) 2018-12-13 US disclosed
US-20180311129-A1 AGENT FOR HAIR DEFORMING TREATMENT KAO CORPORATION (JP) 2018-11-01 US disclosed
WO-2017207767-A1 HAIR COSMETIC COMPOSITION KAO CORPORATION (JP) 2017-12-07 WO disclosed
EP-3228300-A1 HAIR DEFORMATION TREATMENT AGENT Kao Corporation (JP) 2017-10-11 EP disclosed
EP-3228302-A1 HAIR DEFORMATION TREATMENT AGENT Kao Corporation (JP) 2017-10-11 EP disclosed
CN-106999382-A Hair deformation process agent 花王株式会社 2017-08-01 CN disclosed
CN-106999380-A Hair deforming agent 花王株式会社 2017-08-01 CN disclosed
EP-2584896-A2 HERBICIDAL COMPOSITIONS BASF SE (DE) 2013-05-01 EP disclosed
US-20130102463-A1 Herbicidal Compositions BASF SE (DE) 2013-04-25 US disclosed
WO-2011161105-A2 HERBICIDAL COMPOSITIONS BASF SE (DE) 2011-12-29 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 (10 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-11045402-B2 Hair cosmetic composition CUTA, GRHPR, POLR1C PTPN1 3019/4885PTPN11 3413/4885KAT8 53/4885
US-10959925-B2 Hair cosmetic composition CUTA, POLR1C, GRHPR PTPN1 1901/4885PTPN11 1955/4885KAT8 45/4885
US-20180353406-A1 AGENT FOR HAIR DEFORMING TREATMENT GRHPR, SLC26A4, COL1A1 PTPN1 4152/4885PTPN11 4220/4885KAT8 2156/4885
US-20130102463-A1 Herbicidal Compositions PPOX, PAOX, DDT PTPN1 166/4885PTPN11 317/4885KAT8 3725/4885
US-20190254943-A1 HAIR COSMETIC COMPOSITION CUTA, POLR1C, GRHPR PTPN1 1901/4885PTPN11 1955/4885KAT8 45/4885
US-20180311129-A1 AGENT FOR HAIR DEFORMING TREATMENT COL1A1, COL2A1, GRHPR PTPN1 4460/4885PTPN11 4500/4885KAT8 1047/4885
US-20190125052-A1 METHOD FOR TREATING HAIR GRHPR, TYR, POLR1C PTPN1 3312/4885PTPN11 3300/4885KAT8 287/4885
US-20190224093-A1 HAIR COSMETIC COMPOSITION CUTA, GRHPR, POLR1C PTPN1 3019/4885PTPN11 3413/4885KAT8 53/4885
US-11129781-B2 Agent for hair deforming treatment GRHPR, SLC26A4, COL1A1 PTPN1 4152/4885PTPN11 4220/4885KAT8 2156/4885
US-20190290564-A1 HAIR COSMETIC COMPOSITION GRHPR, POLR1C, TYR PTPN1 2171/4885PTPN11 2223/4885KAT8 90/4885

“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.