SCHEMBL645859

SCHEMBL645859

CC(C)(C)OC(=O)CCCC(=O)O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.58
SLC22A6 Q4U2R8 2/20 0.50
LMNA P02545 2/20 0.43
NFKB1 P19838 1/20 0.42
PMP22 Q01453 1/20 0.42
AKR1B1 P15121 1/20 0.41
ALDH1A1 P00352 3/20 0.40
GPR84 Q9NQS5 6/20 0.39
PPARG P37231 6/20 0.39
PPARD Q03181 6/20 0.39
PPARA Q07869 6/20 0.39
HDAC11 Q96DB2 5/20 0.39
TLR2 O60603 2/20 0.39
TDP1 Q9NUW8 2/20 0.39
FABP4 P15090 2/20 0.39
PTPN1 P18031 2/20 0.39
SLC22A8 Q8TCC7 1/20 0.39
MEN1 O00255 1/20 0.39
ESR1 P03372 1/20 0.39
ALOX15 P16050 1/20 0.39

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
Ammonia Solution, Strong SCHEMBL27537263 0.98 TSHR (0.56) TSHRSLC22A6LMNANFKB1PMP22
SCHEMBL1403596 0.95 TSHR (0.52) TSHRSLC22A6LMNANFKB1PMP22
SCHEMBL2182221 0.93 TSHR (0.52) TSHRSLC22A6LMNANFKB1PMP22
SCHEMBL16342359 0.93 TSHR (0.52) TSHRSLC22A6LMNANFKB1PMP22
SCHEMBL2037115 0.93 TSHR (0.52) TSHRSLC22A6LMNANFKB1PMP22
SCHEMBL25176741 0.93 TSHR (0.52) TSHRSLC22A6LMNANFKB1PMP22
SCHEMBL16323109 0.93 TSHR (0.52) TSHRSLC22A6LMNANFKB1PMP22
SCHEMBL414546 0.93 TSHR (0.52) TSHRSLC22A6LMNANFKB1PMP22
SCHEMBL20897215 0.93 TSHR (0.52) TSHRSLC22A6LMNANFKB1PMP22
SCHEMBL557403 0.93 TSHR (0.52) TSHRSLC22A6LMNANFKB1PMP22

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250367332-A1 PSMA-TARGETED RADIOACTIVE METAL COMPLEX CONTAINING NITROAROMATIC HETEROCYCLIC GROUP AND PREPARATION METHOD UNIV BEIJING NORMAL (CN) 2025-12-04 US claimed
CN-119638781-B Synthesis method of antibody-coupled drug linker 瑞博(苏州)制药有限公司 2025-05-16 CN claimed
CN-119638781-A Synthesis method of antibody-coupled drug linker 瑞博(苏州)制药有限公司 2025-03-18 CN claimed
CN-119604492-A Radiolabeled FAPI complex and preparation method and application thereof 北京师范大学 2025-03-11 CN claimed
WO-2023231452-A1 PSMA-TARGETING RADIOACTIVE METAL COMPLEX CONTAINING NITRO AROMATIC HETEROCYCLIC GROUP AND PREPARATION THEREOF 北京师范大学 2023-12-07 WO claimed
CN-116507630-A PSMA targeted radioactive metal complex containing nitro aromatic heterocyclic group and preparation thereof 北京师范大学 2023-07-28 CN claimed
US-6004823-A Compounds SMITHKLINE BEECHAM CORPORATION (US) 1999-12-21 US claimed
EP-4746849-A1 PHARMACEUTICAL COMPOSITIONS OF INSULIN DERIVATIVES Novo Nordisk A/S (DK) 2026-05-27 EP disclosed
EP-4368686-B1 LUBRICITY IMPROVER COMPOSITION FOR FUEL OIL AND USE THEREOF CHINA PETROLEUM & CHEM CORP (CN) 2026-05-27 EP disclosed
CN-122071478-A Compound for targeted degradation of GLI1 protein and medicinal application thereof 苏州大学 2026-05-22 CN disclosed
CN-122055379-A Compounds containing one or more diboronate esters and related insulin analogues 普罗托莫科技公司 2026-05-15 CN disclosed
WO-2026098519-A1 RADIOLIGAND COMPOUNDS AND USES THEREOF Chengdu New Radiomedicine Technology Co., Ltd. (CN) 2026-05-15 WO disclosed
CN-120590466-B Compound of targeted fibroblast activation protein and application thereof 首都医科大学脑重大疾病研究中心(北京脑重大疾病研究院) 2026-05-12 CN disclosed
US-4464521-A EPOXIDIZED FULVENES AS BINDER FOR AGGREGATE; FOUNDRY BINDERS ASHLAND OIL, INC. (US) 1984-08-07 US disclosed
US-4390675-A EPOXYFULVENE, ACID CATALYST ASHLAND OIL, INC. (US) 1983-06-28 US disclosed
US-4349552-A TREATMENT OF CANCER FUJISAWA PHARMACEUTICAL COMPANY, LTD. (JP) 1982-09-14 US disclosed
EP-0010941-B1 5-FLUOROURACIL DERIVATIVES, PREPARATION THEREOF AND THEIR PHARMACEUTICAL COMPOSITIONS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1982-05-12 EP disclosed
US-4220578-A Method, resin and catalyst for increasing the tensile strength and core hardness of a sand mold or core CL INDUSTRIES INC. (US) 1980-09-02 US disclosed
US-4215012-A SULFUR-FREE; DIALKYL ESTER COMPOUND AND A LEWIS ACID, POLYMERIZATION CATALYST C L INDUSTRIES, INC. (US) 1980-07-29 US disclosed
EP-0010941-A1 5-Fluorouracil derivatives, preparation thereof and their pharmaceutical compositions FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1980-05-14 EP 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 (1 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-20250367332-A1 PSMA-TARGETED RADIOACTIVE METAL COMPLEX CONTAINING NITROAROMATIC HETEROCYCLIC GROUP AND PREPARATION METHOD PSMA1, PSMA2, PSMA7 TSHR 2373/4885SLC22A6 779/4885LMNA 2001/4885

“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.