SCHEMBL167161

SCHEMBL167161

CCOC(=O)C(=O)c1ccc(C)cc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 3/20 0.60
CES1 P23141 3/20 0.60
ALDH1A1 P00352 5/20 0.53
MAPT P10636 1/20 0.53
GAA P10253 2/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
HTT P42858 1/20 0.51
DHODH Q02127 1/20 0.50
LMNA P02545 2/20 0.48
KMT2A Q03164 1/20 0.47
CA12 O43570 1/20 0.47
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
ESR1 P03372 1/20 0.47
CA7 P43166 1/20 0.47
CA9 Q16790 1/20 0.47
ESR2 Q92731 1/20 0.47
CA14 Q9ULX7 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
RAB9A P51151 3/20 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
SCHEMBL11839592 0.94 CES2 (0.54) CES2CES1ALDH1A1MAPTGAA
SCHEMBL20326025 0.91 MMP13 (0.53) CES2CES1ALDH1A1MAPTGAA
SCHEMBL21636244 0.88 MAPT (0.53) CES2CES1ALDH1A1MAPTSMN1; SMN2
SCHEMBL641616 0.86 CA12 (0.66) CES2ALDH1A1MAPTSMN1; SMN2LMNA
SCHEMBL166220 0.84 MAPT (0.57) CES2CES1ALDH1A1MAPTGAA
SCHEMBL13909369 0.84 ALDH1A1 (0.50) CES2CES1ALDH1A1MAPTHTT
SCHEMBL9041402 0.84 MAPT (0.50) CES2CES1ALDH1A1MAPTGAA
SCHEMBL21636242 0.84 KMT2A (0.50) CES2CES1ALDH1A1MAPTSMN1; SMN2
SCHEMBL1408429 0.84 LMNA (0.67) ALDH1A1MAPTGAASMN1; SMN2HTT
SCHEMBL696315 0.84 KMT2A (0.57) CES2CES1ALDH1A1MAPTGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3619214-B1 GAMMA-SPIROKETAL-GAMMA-LACTONES AND PHARMACEUTICAL COMPOSITION CONTAINING SAME AND PROCESS FOR PREPARATION THEREOF COUNCIL SCIENT IND RES (IN) 2024-11-06 EP claimed
US-11339174-B2 γ-spiroketal-γ-lactones and pharmaceutical composition containing same and process for preparation thereof COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2022-05-24 US claimed
US-20210198273-A1 GAMMA-SPIROKETAL-GAMMA-LACTONES AND PHARMACEUTICAL COMPOSITION CONTAINING SAME AND PROCESS FOR PREPARATION THEREOF COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2021-07-01 US claimed
EP-3619214-A1 GAMMA-SPIROKETAL-GAMMA-LACTONES AND PHARMACEUTICAL COMPOSITION CONTAINING SAME AND PROCESS FOR PREPARATION THEREOF Council of Scientific and Industrial Research (IN) 2020-03-11 EP claimed
WO-2018203346-A1 γ-SPIROKETAL- γ –LACTONES AND PHARMACEUTICAL COMPOSITION CONTAINING SAME AND PROCESS FOR PREPARATION THEREOF COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2018-11-08 WO claimed
US-20260070874-A1 BENZOYLFORMIC ACID AMIDE DERIVATIVE KJ CHEMICALS CORPORATION (JP) 2026-03-12 US disclosed
US-12516065-B2 Tertiary alcohols as PI3K-γ inhibitors INCYTE CORPORATION (US) 2026-01-06 US disclosed
EP-4610249-A1 BENZOYLFORMIC ACID AMIDE DERIVATIVE KJ Chemicals Corporation (JP) 2025-09-03 EP disclosed
EP-3619214-B1 GAMMA-SPIROKETAL-GAMMA-LACTONES AND PHARMACEUTICAL COMPOSITION CONTAINING SAME AND PROCESS FOR PREPARATION THEREOF COUNCIL SCIENT IND RES (IN) 2024-11-06 EP disclosed
WO-2024210074-A1 BENZOYLFORMIC ACID AMIDE DERIVATIVE KJケミカルズ株式会社 2024-10-10 WO disclosed
US-20240228498-A1 TERTIARY ALCOHOLS AS PI3K-y INHIBITORS INCYTE CORPORATION 2024-07-11 US disclosed
CN-118063470-A Condensed imidazole derivatives substituted with tertiary hydroxyl groups as PI 3K-gamma inhibitors 因赛特公司 2024-05-24 CN disclosed
US-6329547-B1 USEFUL AS THERAPEUTIC AGENTS FOR GLAUCOMA SANTEN PHARMACEUTICAL CO., LTD. (JP) 2001-12-11 US disclosed
EP-1094055-A1 NOVEL VINYLBENZENE DERIVATIVES SANTEN PHARMACEUTICAL CO., LTD. (JP) 2001-04-25 EP disclosed
EP-0701551-B1 3-(INDOL-3-YL) PROPENOIC ACID DERIVATIVES USEFUL AS NMDA ANTAGONISTS MERRELL PHARMA INC (US) 1997-04-16 EP disclosed
US-5519048-A 3-(indol-3-yl)-propenoic acid derivatives and pharmaceutical compositions thereof MERRELL PHARMACEUTICALS INC. (US) 1996-05-21 US disclosed
EP-0701551-A1 3-(INDOL-3-YL) PROPENOIC ACID DERIVATIVES AND AS NMDA ANTAGONISTS MERRELL PHARMA INC (US) 1996-03-20 EP disclosed
WO-1994027964-A1 3-(INDOL-3-YL) PROPENOIC ACID DERIVATIVES AND AS NMDA ANTAGONISTS MERRELL DOW PHARMACEUTICALS INC. (US) 1994-12-08 WO disclosed
EP-0543491-A2 Angiotensin II antagonists having a substituted 1,3-benzodioxolering or 1,3-benzodithiolering MERCK & CO. INC. (US) 1993-05-26 EP disclosed
US-5187159-A Hypotensive agents, psychological disorders MERCK & CO., INC. (US) 1993-02-16 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 (4 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-20240228498-A1 TERTIARY ALCOHOLS AS PI3K-y INHIBITORS PIK3R5, PIK3R1, PIK3CD CES2 2271/4885CES1 660/4885ALDH1A1 333/4885
US-11339174-B2 γ-spiroketal-γ-lactones and pharmaceutical composition containing same and process for preparation thereof HSD17B7, PKD1, CYP17A1 CES2 3614/4885CES1 895/4885ALDH1A1 420/4885
US-20210198273-A1 GAMMA-SPIROKETAL-GAMMA-LACTONES AND PHARMACEUTICAL COMPOSITION CONTAINING SAME AND PROCESS FOR PREPARATION THEREOF HSD17B7, PKD1, CYP17A1 CES2 3608/4885CES1 883/4885ALDH1A1 377/4885
US-20260070874-A1 BENZOYLFORMIC ACID AMIDE DERIVATIVE CRYAA, BCAT1, BRCA1 CES2 1111/4885CES1 945/4885ALDH1A1 88/4885

“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.