SCHEMBL10248

SCHEMBL10248

CC1(C)OB(c2cccc(C(F)(F)F)c2)OC1(C)C

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LPL P06858 8/20 0.48
LIPG Q9Y5X9 8/20 0.48
TSHR P16473 1/20 0.40
MAPK1 P28482 1/20 0.40
PDGFRB P09619 1/20 0.39
KDR P35968 1/20 0.39
LMNA P02545 1/20 0.38
F2 P00734 1/20 0.38
F11 P03951 1/20 0.38
PRSS1 P07477 1/20 0.38
PRSS2 P07478 1/20 0.38
PRSS3 P35030 1/20 0.38
AR P10275 1/20 0.37
CES2 O00748 1/20 0.37
MGLL Q99685 1/20 0.37
HTR2A P28223 1/20 0.37
HTR2C P28335 1/20 0.37
HTR2B P41595 1/20 0.37
IRAK4 Q9NWZ3 1/20 0.36

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
SCHEMBL4427545 0.88 LIPG (0.47) LPLLIPGF2F11PRSS1
SCHEMBL4297460 0.87 LIPG (0.46) LPLLIPGF2F11PRSS1
SCHEMBL30896564 0.87 LIPG (0.46) LPLLIPGF2F11PRSS1
SCHEMBL23031848 0.87 LIPG (0.46) LPLLIPGF2F11PRSS1
SCHEMBL21369829 0.87 LIPG (0.46) LPLLIPGF2F11PRSS1
SCHEMBL22747541 0.87 TEAD1 (0.43) LPLLIPG
SCHEMBL2299910 0.85 LIPG (0.47) LPLLIPGPDGFRBKDRF2
SCHEMBL581812 0.84 LIPG (0.49) LPLLIPGIRAK4
SCHEMBL29560947 0.84 LIPG (0.49) LPLLIPGIRAK4
SCHEMBL2030174 0.84 LIPG (0.43) LPLLIPGTSHRMAPK1PDGFRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12076715-B1 Synthesis and characterization of air-stable iron-based catalysts for Suzuki-Miyaura cross-coupling reactions of alkyl halides and aryl boronic esters THE TRUSTEES OF BOSTON COLLEGE (MA) 2024-09-03 US claimed
US-7037905-B2 Pharmaceutical use of boronic acids and esters thereof NOVO NORDISK A/S (DK) 2006-05-02 US claimed
US-20040053889-A1 Pharmaceutical use of boronic acids and esters thereof NOVO NORDISK A/S (DK) 2004-03-18 US claimed
WO-2003105860-A1 PHARMACEUTICAL USE OF BORONIC ACIDS AND ESTERS THEREOF NOVO NORDISK A/S (DK) 2003-12-24 WO claimed
CN-120727979-A High-temperature high-pressure electrolyte additive, electrolyte containing same and lithium ion battery 中国科学院福建物质结构研究所 2025-09-30 CN disclosed
WO-2025003987-A1 NOVEL CARBOXAMIDE DERIVATIVE COMPOUND AND PHARMACEUTICAL COMPOSITION COMPRISING SAME 동화약품주식회사 2025-01-02 WO disclosed
US-20240391884-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NOVARTIS AG (CH) 2024-11-28 US disclosed
US-20240391930-A1 SPIROCYCLIC BICYCLIC MODULATORS OF CHOLESTEROL BIOSYNTHESIS AND THEIR USE FOR PROMOTING REMYELINATION GENENTECH, INC. 2024-11-28 US disclosed
EP-4436974-A1 SPIROCYCLIC BICYCLIC MODULATORS OF CHOLESTEROL BIOSYNTHESIS AND THEIR USE FOR PROMOTING REMYELINATION Genentech, Inc. (US) 2024-10-02 EP disclosed
US-12076715-B1 Synthesis and characterization of air-stable iron-based catalysts for Suzuki-Miyaura cross-coupling reactions of alkyl halides and aryl boronic esters THE TRUSTEES OF BOSTON COLLEGE (MA) 2024-09-03 US disclosed
CN-118546107-A 2-Thiazole aminophenol derivatives and application thereof 中国药科大学 2024-08-27 CN disclosed
CN-118496156-A Compounds with STING inhibition activity, preparation method and application thereof 中国科学院上海药物研究所 2024-08-16 CN disclosed
US-20110082164-A1 POLYCYCLIC COMPOUNDS AS LYSOPHOSPHATIDIC ACID RECEPTOR ANTAGONISTS AMIRA PHARMACEUTICALS, INC. (US) 2011-04-07 US disclosed
WO-2011041462-A2 POLYCYCLIC COMPOUNDS AS LYSOPHOSPHATIDIC ACID RECEPTOR ANTAGONISTS AMIRA PHARMACEUTICALS, INC. (US) 2011-04-07 WO disclosed
EP-2203171-A2 CB2 RECEPTOR LIGANDS FOR THE TREATMENT OF PAIN Merck Sharp & Dohme Corp. (US) 2010-07-07 EP disclosed
WO-2010002209-A2 NOVEL COMPOUNDS, ISOMER THEREOF, OR PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF AS VANILLOID RECEPTOR ANTAGONIST AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME AMOREPACIFIC CORPORATION (KR) 2010-01-07 WO disclosed
WO-2009025785-A2 CB2 RECEPTOR LIGANDS FOR THE TREATMENT OF PAIN MERCK & CO., INC. (US) 2009-02-26 WO disclosed
US-7037905-B2 Pharmaceutical use of boronic acids and esters thereof NOVO NORDISK A/S (DK) 2006-05-02 US disclosed
US-20040053889-A1 Pharmaceutical use of boronic acids and esters thereof NOVO NORDISK A/S (DK) 2004-03-18 US disclosed
WO-2003105860-A1 PHARMACEUTICAL USE OF BORONIC ACIDS AND ESTERS THEREOF NOVO NORDISK A/S (DK) 2003-12-24 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-20240391930-A1 SPIROCYCLIC BICYCLIC MODULATORS OF CHOLESTEROL BIOSYNTHESIS AND THEIR USE FOR PROMOTING REMYELINATION MAG, SGMS1, PMP22 LPL 412/4885LIPG 754/4885TSHR 4528/4885
US-20040053889-A1 Pharmaceutical use of boronic acids and esters thereof LIPE, CEL, LIPA LPL 5/4885LIPG 8/4885TSHR 315/4885
US-12076715-B1 Synthesis and characterization of air-stable iron-based catalysts for Suzuki-Miyaura cross-coupling reactions of alkyl halides and aryl boronic esters NBAS, BLVRB, TFRC LPL 3353/4885LIPG 3117/4885TSHR 227/4885
US-20110082164-A1 POLYCYCLIC COMPOUNDS AS LYSOPHOSPHATIDIC ACID RECEPTOR ANTAGONISTS LPAR1, LPAR2, LPAR4 LPL 126/4885LIPG 105/4885TSHR 519/4885
US-20240391884-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NLRP1, NLRP3, NOD1 LPL 264/4885LIPG 385/4885TSHR 4271/4885

“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.