SCHEMBL221480

SCHEMBL221480

O=C(O)c1cc(F)c(F)c(F)c1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 3/20 0.67
CES1 P23141 3/20 0.67
CA1 P00915 3/20 0.52
CA2 P00918 3/20 0.52
LMNA P02545 3/20 0.52
CA12 O43570 2/20 0.52
CA7 P43166 2/20 0.52
CA9 Q16790 2/20 0.52
CA14 Q9ULX7 2/20 0.52
MAPK1 P28482 2/20 0.52
TP53 P04637 2/20 0.52
CA4 P22748 2/20 0.52
KDM4E B2RXH2 2/20 0.52
HSD17B10 Q99714 2/20 0.52
ALDH1A1 P00352 1/20 0.52
CA3 P07451 1/20 0.52
MAPT P10636 1/20 0.52
SELL P14151 1/20 0.52
HPGD P15428 1/20 0.52
SELP P16109 1/20 0.52

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
SCHEMBL31210112 0.85 CA12 (0.62) CES2CES1CA1CA2LMNA
SCHEMBL26690845 0.85 CA12 (0.62) CES2CES1CA1CA2LMNA
SCHEMBL2183846 0.84 CES2 (0.48) CES2CES1CA1CA2LMNA
SCHEMBL29738515 0.84 TTR (0.56) CES2CES1CA1CA2LMNA
SCHEMBL2431319 0.84 TTR (0.56) CES2CES1CA1CA2LMNA
SCHEMBL23815308 0.84 TPMT (0.58) CES2CES1CA1CA2LMNA
SCHEMBL30753326 0.84 TTR (0.56) CES2CES1CA1CA2LMNA
SCHEMBL1724284 0.84 TTR (0.56) CES2CES1CA1CA2LMNA
SCHEMBL14213195 0.83 TTR (0.55) CES2CES1CA1CA2LMNA
SCHEMBL542833 0.81 LMNA (0.50) CES2CES1CA1CA2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118754797-B Synthesis method of 3,4, 5-trifluoro-bromobenzene 台州鸿都生物科技有限公司 2025-01-24 CN claimed
CN-118754797-A Synthesis method of 3,4, 5-trifluoro-bromobenzene 台州鸿都生物科技有限公司 2024-10-11 CN claimed
CN-117832755-A Functional diaphragm for lithium-sulfur battery and preparation method thereof 成都职业技术学院 2024-04-05 CN claimed
CN-117596997-A Semitransparent polymer solar cell and preparation method thereof 四川大学 2024-02-23 CN claimed
CN-115181054-A Synthetic method of 3-benzyl indole compound 合肥工业大学 2022-10-14 CN claimed
CN-114409887-A Fluorinated terminal group amphiphilic polymer, and preparation method and application thereof 浙江大学杭州国际科创中心 2022-04-29 CN claimed
CN-113956877-A Preparation of organic fluorine-containing carbon quantum dot with near-infrared excitation/emission property 重庆医科大学 2022-01-21 CN claimed
CN-112094586-B High-wear-resistance hydrophobic coating and preparation method thereof 丹阳市精通眼镜技术创新服务中心有限公司 2021-11-09 CN claimed
CN-112094586-A High-wear-resistance hydrophobic coating and preparation method thereof 丹阳市精通眼镜技术创新服务中心有限公司 2020-12-18 CN claimed
CN-107681052-B Main group metal complexes as p-dopants for organic electronic matrix materials 西门子公司 2020-03-24 CN claimed
US-20060020141-A1 Metallized dye XEROX CORPORATION 2006-01-26 US claimed
US-6946025-B2 Process for preparing tetra-amide compounds XEROX CORPORATION (US) 2005-09-20 US claimed
US-20050090690-A1 Process for preparing tetra-amide compounds XEROX CORPORATION 2005-04-28 US claimed
EP-1511713-A2 COMPOUNDS THAT ABROGATE DNA-DAMAGE-INDUCED CELL CYCLE G2 CHECKPOINT AND/OR AUGMENT THE ANTI-CANCER ACTIVITY OF DNA-DAMAGING TREATMENTS Canbas Co. Ltd. (JP) 2005-03-09 EP claimed
US-20040198727-A1 Compounds that abrogate DNA-damage-induced cell cycle G2 checkpoint and/or augment the anti-cancer activity of DNA damaging treatments CANBAS CO., LTD. (JP) 2004-10-07 US claimed
US-20040094297-A1 Method for determining the extent of recovery of materials injected into oil wells or subsurface formations during oil and gas exploration and production CORE LABORATORIES LP 2004-05-20 US claimed
WO-2003104181-A2 COMPOUNDS THAT ABROGATE DNA-DAMAGE-INDUCED CELL CYCLE G2 CHECKPOINT AND/OR AUGMENT THE ANTI-CANCER ACTIVITY OF DNA-DAMAGING TREATMENTS CANBAS CO. LTD. (JP) 2003-12-18 WO claimed
US-6659175-B2 Mixing water, buffers, oxidizers, gels, gelation inhibitors, stabilizer and curing agents with tracers, then pumping the mixtures into bores, withdrawing fluids and measuring concentration of labels; well completion efficiency CORE LABORATORIES, INC. 2003-12-09 US claimed
US-20030006036-A1 Mixing water, buffers, oxidizers, gels, gelation inhibitors, stabilizer and curing agents with tracers, then pumping the mixtures into bores, withdrawing fluids and measuring concentration of labels; well completion efficiency CORE LABORATORIES GLOBAL N.V. (NL) 2003-01-09 US claimed
WO-2002095189-A1 METHOD OF DETERMINING THE EXTENT OF RECOVERY OF MATERIALS INJECTED INTO OIL WELLS CORE LABORATORIES L.P. (US) 2002-11-28 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 (3 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-20040198727-A1 Compounds that abrogate DNA-damage-induced cell cycle G2 checkpoint and/or augment the anti-cancer activity of DNA damaging treatments CDC25C, CHEK1, DDB1 CES2 4525/4885CES1 3681/4885CA1 3472/4885
US-20060020141-A1 Metallized dye CDYL, CDY1; CDY1B, CDYL2 CES2 1598/4885CES1 3489/4885CA1 102/4885
US-20050090690-A1 Process for preparing tetra-amide compounds TAF9, TAF5, TAF1 CES2 2351/4885CES1 3786/4885CA1 139/4885

“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.