SCHEMBL291362

SCHEMBL291362

[CH2]OCc1ccc(OC)c(OC)c1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.63
ALDH1A1 P00352 2/20 0.58
PPARG P37231 1/20 0.58
PPARD Q03181 1/20 0.58
PPARA Q07869 1/20 0.58
ATM Q13315 2/20 0.55
KDM4E B2RXH2 1/20 0.55
POLB P06746 1/20 0.52
CYP19A1 P11511 1/20 0.52
CYP1A2 P05177 1/20 0.52
CYP3A4 P08684 1/20 0.52
CYP2D6 P10635 1/20 0.52
ABCB1 P08183 2/20 0.50
BLM P54132 1/20 0.50
PMP22 Q01453 1/20 0.50
MAPT P10636 1/20 0.50
AOC3 Q16853 1/20 0.49
LDHA P00338 1/20 0.49
ABCG2 Q9UNQ0 1/20 0.47
SIGMAR1 Q99720 1/20 0.47

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
SCHEMBL29475007 0.83 CA2 (0.68) CA2ALDH1A1PPARGPPARDPPARA
SCHEMBL318036 0.83 CA2 (0.68) CA2ALDH1A1PPARGPPARDPPARA
SCHEMBL291363 0.83 CA2 (0.68) CA2ALDH1A1PPARGPPARDPPARA
SCHEMBL28891118 0.80 CA2 (0.53) CA2ALDH1A1PPARGPPARDPPARA
SCHEMBL7956494 0.80 CA2 (0.59) CA2ALDH1A1PPARGPPARDPPARA
SCHEMBL28355585 0.79 ALDH1A1 (0.48) CA2ALDH1A1PPARGPPARDPPARA
SCHEMBL839475 0.79 ATM (0.66) CA2ALDH1A1PPARGPPARDPPARA
SCHEMBL27710619 0.79 CA2 (0.63) CA2ALDH1A1PPARGPPARDPPARA
SCHEMBL11008456 0.79 CA2 (0.63) CA2ALDH1A1PPARGPPARDPPARA
SCHEMBL435158 0.79 CA2 (0.63) CA2ALDH1A1PPARGPPARDPPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110997645-B Preparation method of ozagrel 埃吉斯制药公司 2023-10-10 CN claimed
EP-3630738-B1 PROCESS FOR THE PRODUCTION OF OZANIMOD EGYT GYOGYSZERVEGYESZETI GYAR (HU) 2023-07-19 EP claimed
EP-3634970-B1 NOVEL PROCESS FOR PREPARATION OF EMPAGLIFLOZIN OR ITS CO-CRYSTALS, SOLVATES AND THEIR POLYMORPHS THEREOF LAURUS LABS LTD (IN) 2023-07-19 EP claimed
US-20230057246-A1 NOVEL PROCESSES FOR PREPARATION OF TEZACAFTOR LAURUS LABS LIMITED (IN) 2023-02-23 US claimed
EP-4099991-A1 NOVEL PROCESSES FOR PREPARATION OF TEZACAFTOR Laurus Labs Limited (IN) 2022-12-14 EP claimed
US-20210323939-A1 NOVEL PROCESSES FOR PREPARATION OF DAPAGLIFLOZIN OR ITS SOLVATES OR CO-CRYSTALS THEREOF LAURUS LABS LIMITED (IN) 2021-10-21 US claimed
WO-2021156811-A1 NOVEL PROCESSES FOR PREPARATION OF TEZACAFTOR LAURUS LABS LIMITED (IN) 2021-08-12 WO claimed
US-11046676-B2 Process for preparation of empagliflozin or its co-crystals, solvates and their polymorphs thereof LAURUS LABS LIMITED (IN) 2021-06-29 US claimed
US-20200131163-A1 NOVEL PROCESS FOR PREPARATION OF EMPAGLIFLOZIN OR ITS CO-CRYSTALS, SOLVATES AND THEIR POLYMORPHS THEREOF LAURUS LABS LIMITED (IN) 2020-04-30 US claimed
EP-3634970-A1 NOVEL PROCESS FOR PREPARATION OF EMPAGLIFLOZIN OR ITS CO-CRYSTALS, SOLVATES AND THEIR POLYMORPHS THEREOF Laurus Labs Limited (IN) 2020-04-15 EP claimed
US-20130177952-A1 METHOD OF PRODUCING INGENOL-3-ANGELATE Hogberg, Thomas (DK) 2013-07-11 US claimed
EP-2595948-A1 A METHOD OF PRODUCING INGENOL-3-ANGELATE LEO LABORATORIES LIMITED (IE) 2013-05-29 EP claimed
CN-102725285-A (3-fluoro-2-hydroxy) propyl-functional aryl derivative or pharmaceutically acceptable salt thereof, method for preparing same, and pharmaceutical composition for diagnosing or treating brain degenerative diseases comprising same as active ingredient FUTURECHEM CO LTD 2012-10-10 CN claimed
WO-2012131077-A1 SOMATOSTATIN MIMETICS NATIONAL UNIVERSITY OF IRELAND, GALWAY (IE) 2012-10-04 WO claimed
US-20120214994-A1 (3-FLUORO-2-HYDROXY)PROPYL-FUNCTIONALIZED ARYL DERIVATIVES OR PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF, METHOD FOR PREPARING SAME, AND PHARMACEUTICAL COMPOSITION CONTAINING SAME AS ACTIVE INGREDIENT FOR THE DIAGNOSIS OR TREATMENT OF NEURODEGENERATIVE BRAIN DISEASES FUTURECHEM CO., LTD. (KR) 2012-08-23 US claimed
WO-2012010172-A1 A METHOD OF PRODUCING INGENOL-3-ANGELATE LEO PHARMA A/S (DK) 2012-01-26 WO claimed
US-20100137277-A1 PYRIDINE COMPOUNDS AND THEIR USE AS P2Y12 ANTAGONISTS ASTRAZENECA AB (SE) 2010-06-03 US claimed
EP-2111400-A1 PYRIDINE COMPOUNDS AND THEIR USE AS P2Y12 ANTAGONISTS. AstraZeneca AB (SE) 2009-10-28 EP claimed
US-20080171732-A1 New Pyridine Analogues IX 519 ASTRAZENECA AB (SE) 2008-07-17 US claimed
WO-2008085117-A1 PYRIDINE COMPOUNDS AND THEIR USE AS P2Y12 ANTAGONISTS. ASTRAZENECA AB (SE) 2008-07-17 WO claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (8 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-20200131163-A1 NOVEL PROCESS FOR PREPARATION OF EMPAGLIFLOZIN OR ITS CO-CRYSTALS, SOLVATES AND THEIR POLYMORPHS THEREOF SLC5A1, SLC5A2, DPP4 CA2 745/4885ALDH1A1 2860/4885PPARG 327/4885
US-20080171732-A1 New Pyridine Analogues IX 519 P2RY12, P2RY11, P2RY1 CA2 2341/4885ALDH1A1 1518/4885PPARG 228/4885
US-20230057246-A1 NOVEL PROCESSES FOR PREPARATION OF TEZACAFTOR CYP3A4, CYP4A11, CYP3A43 CA2 3326/4885ALDH1A1 553/4885PPARG 2759/4885
US-20120214994-A1 (3-FLUORO-2-HYDROXY)PROPYL-FUNCTIONALIZED ARYL DERIVATIVES OR PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF, METHOD FOR PREPARING SAME, AND PHARMACEUTICAL COMPOSITION CONTAINING SAME AS ACTIVE INGREDIENT FOR THE DIAGNOSIS OR TREATMENT OF NEURODEGENERATIVE BRAIN DISEASES APP, FABP7, SLC3A2 CA2 1695/4885ALDH1A1 2595/4885PPARG 1888/4885
US-20130177952-A1 METHOD OF PRODUCING INGENOL-3-ANGELATE PRKAG3, AMPD3, ERG28 CA2 1415/4885ALDH1A1 1005/4885PPARG 117/4885
US-11046676-B2 Process for preparation of empagliflozin or its co-crystals, solvates and their polymorphs thereof SLC5A2, SLC5A1, DPP4 CA2 548/4885ALDH1A1 2460/4885PPARG 321/4885
US-20100137277-A1 PYRIDINE COMPOUNDS AND THEIR USE AS P2Y12 ANTAGONISTS P2RY12, P2RY11, P2RY1 CA2 2193/4885ALDH1A1 1782/4885PPARG 189/4885
US-20210323939-A1 NOVEL PROCESSES FOR PREPARATION OF DAPAGLIFLOZIN OR ITS SOLVATES OR CO-CRYSTALS THEREOF SLC5A1, SLC5A2, DPP4 CA2 429/4885ALDH1A1 1945/4885PPARG 250/4885

“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.