SCHEMBL6865291

SCHEMBL6865291

CCCOC(=O)c1c(C)cccc1C(=O)OO

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.56
LMNA P02545 3/20 0.46
TSHR P16473 6/20 0.45
TDP1 Q9NUW8 2/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
MAPK1 P28482 2/20 0.44
TP53 P04637 1/20 0.44
CYP3A4 P08684 1/20 0.44
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA7 P43166 1/20 0.44
CA9 Q16790 1/20 0.44
CA14 Q9ULX7 1/20 0.44
GRM6 O15303 1/20 0.42
ESR1 P03372 1/20 0.41
CHRM1 P11229 1/20 0.41
SLC6A2 P23975 1/20 0.41
KDR P35968 1/20 0.41
ADORA3 P0DMS8 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
SCHEMBL22423696 0.85 ALDH1A1 (0.58) ALDH1A1LMNATSHRTDP1L3MBTL1
SCHEMBL301815 0.83 TSHR (0.68) ALDH1A1LMNATSHRTDP1L3MBTL1
SCHEMBL22289781 0.82 ALDH1A1 (0.75) ALDH1A1LMNATSHRTDP1L3MBTL1
SCHEMBL21113658 0.82 TSHR (0.69) ALDH1A1LMNATSHRTDP1L3MBTL1
SCHEMBL20267422 0.81 ALDH1A1 (0.50) ALDH1A1LMNATSHRTDP1MAPK1
SCHEMBL21113695 0.81 ALDH1A1 (0.69) ALDH1A1LMNATSHRTDP1L3MBTL1
SCHEMBL4626793 0.81 TSHR (0.64) ALDH1A1LMNATSHRTDP1L3MBTL1
SCHEMBL1554746 0.80 ALDH1A1 (0.85) ALDH1A1LMNATSHRTDP1L3MBTL1
SCHEMBL302145 0.80 TSHR (0.66) ALDH1A1TSHRTDP1TP53CYP3A4
SCHEMBL16051215 0.78 ALDH1A1 (0.68) ALDH1A1LMNATSHRTDP1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2019198109-A1 NOVEL PHARMACEUTICAL COMPOSITION OF ESSENTIAL OIL ZIM LABORATORIES LIMITED (IN) 2019-10-17 WO claimed
US-12023365-B2 Sustained release formulations of Crocus sativus COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2024-07-02 US disclosed
WO-2024073056-A1 CUCURBITURIL COMPOSITIONS, PRODUCTS, AND METHODS OF USE Kureha America, Inc. (US) 2024-04-04 WO disclosed
US-20200390843-A1 SUSTAINED RELEASE FORMULATIONS OF CROCUS SATIVUS COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2020-12-17 US disclosed
EP-3697389-A1 SUSTAINED RELEASE FORMULATIONS OFCROCUS SATIVUS Council of Scientific and Industrial Research (IN) 2020-08-26 EP disclosed
WO-2019198109-A1 NOVEL PHARMACEUTICAL COMPOSITION OF ESSENTIAL OIL ZIM LABORATORIES LIMITED (IN) 2019-10-17 WO disclosed
WO-2019077621-A1 SUSTAINED RELEASE FORMULATIONS OF CROCUS SATIVUS COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2019-04-25 WO disclosed
EP-1257269-B1 ORALLY ADMINISTRABLE ACID STABLE ANTI-ULCER BENZIMIDAZOLE DERIVATIVES KOPRAN RES LAB LTD (IN) 2004-11-03 EP disclosed
US-6617338-B2 Orally administrable acid stable antiulcer benzimidazole derivatives KOPRAN RESEARCH LABORATORIES LIMITED (IN) 2003-09-09 US disclosed
US-20030023091-A9 Orally administrable acid stable antiulcer benzimidazole derivatives KOPRAN RESEARCH LABORATORIES LIMITED (IN) 2003-01-30 US disclosed
EP-1257269-A1 ORALLY ADMINISTRABLE ACID STABLE ANTI-ULCER BENZIMIDAZOLE DERIVATIVES Kopran Research Laboratories Limited (IN) 2002-11-20 EP disclosed
US-20020038032-A1 Orally administrable acid stable antiulcer benzimidazole derivatives KOPRAN RESEARCH LABORATORIES LIMITED (IN) 2002-03-28 US disclosed
WO-2001062248-A1 ORALLY ADMINISTRABLE ACID STABLE ANTI-ULCER BENZIMIDAZOLE DERIVATIVES KOPRAN RESEARCH LABORATORIES LIMITED (IN) 2001-08-30 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 (2 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-20030023091-A9 Orally administrable acid stable antiulcer benzimidazole derivatives SI, PGA5, PAICS ALDH1A1 1143/4885LMNA 1613/4885TSHR 4746/4885
US-20020038032-A1 Orally administrable acid stable antiulcer benzimidazole derivatives SI, PGA5, PAICS ALDH1A1 1143/4885LMNA 1613/4885TSHR 4746/4885

“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.