SCHEMBL12304992

SCHEMBL12304992

CC(C)(CCO)OCCC(C)(C)OCCO

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.31
TSHR P16473 1/20 0.30
MAPK1 P28482 1/20 0.30

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
SCHEMBL12446095 0.95 ALDH1A1 (0.33) ALDH1A1TSHRMAPK1
SCHEMBL20851353 0.88
SCHEMBL26667076 0.88 MAPK1 (0.31) MAPK1
SCHEMBL13455172 0.87
SCHEMBL12559718 0.87 TSHR (0.35) ALDH1A1TSHRMAPK1
SCHEMBL19072534 0.87 MEN1 (0.46) ALDH1A1TSHRMAPK1
SCHEMBL13183444 0.86
SCHEMBL12146535 0.86 TSHR (0.30) TSHR
SCHEMBL22355287 0.86 ALDH1A1 (0.33) ALDH1A1
SCHEMBL12819577 0.86 CYP4F2 (0.33)

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11583569-B2 PSMA-targeting amanitin conjugates HEIDELBERG PHARMA RESEARCH GMBH (DE) 2023-02-21 US disclosed
EP-3601206-B1 PROCESS FOR PREPARING AN ANTICORROSION COMPONENT FOR AN ANTIFREEZE BASF SE (DE) 2021-07-21 EP disclosed
US-11066391-B1 Atorvastatin derived HMG-CoA reductase degradation inducing compound UPPTHERA (KR) 2021-07-20 US disclosed
US-20210155746-A1 HYBRID ANIONIC, NONIONIC WATER-BASED POLYURETHANE-POLYUREA U.S. POLYMERS-ACCUREZ, LLC 2021-05-27 US disclosed
US-10961177-B2 Process for preparing an anticorrosion component for an antifreeze BASF SE 2021-03-30 US disclosed
US-20200345807-A1 PSMA-TARGETING AMANITIN CONJUGATES HEIDELBERG PHARMA RESEARCH GMBH (DE) 2020-11-05 US disclosed
US-20200283365-A1 PROCESS FOR PREPARING AN ANTICORROSION COMPONENT FOR AN ANTIFREEZE BASF SE (DE) 2020-09-10 US disclosed
EP-2872496-B1 POLYGLYCOL BIS-[3-(7-TERT-BUTYL-2-OXO-3-PHENYL-3H-BENZOFURAN-5-YL-)PROPANOYL]DERIVATIVES AS STABILIZERS OF ORGANIC MATERIAL BASF SE (DE) 2018-02-28 EP disclosed
WO-2016050210-A1 MULTIFUNCTIONALIZED POLYETHYLENE GLYCOL DERIVATIVE AND PREPARATION METHOD THEREFOR 厦门赛诺邦格生物科技有限公司 2016-04-07 WO disclosed
US-20110142941-A1 Nanoparticle and Polymer Formulations for Thyroid Hormone Analogs, Antagonists, and Formulations and Uses Thereof NANOPHARMACEUTICALS LLC 2011-06-16 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 (6 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-11066391-B1 Atorvastatin derived HMG-CoA reductase degradation inducing compound HMGCR, LDLR, HMGB2 ALDH1A1 1806/4885TSHR 4230/4885MAPK1 3926/4885
US-20200345807-A1 PSMA-TARGETING AMANITIN CONJUGATES FOLH1, ANPEP, PSMA6 ALDH1A1 2847/4885TSHR 2131/4885MAPK1 4107/4885
US-20200283365-A1 PROCESS FOR PREPARING AN ANTICORROSION COMPONENT FOR AN ANTIFREEZE POLA1, SERPINC1, POLD1 ALDH1A1 2366/4885TSHR 4121/4885MAPK1 1095/4885
US-20110142941-A1 Nanoparticle and Polymer Formulations for Thyroid Hormone Analogs, Antagonists, and Formulations and Uses Thereof TSHR, THRA, TRHR ALDH1A1 3675/4885TSHR 1/4885MAPK1 2321/4885
US-11583569-B2 PSMA-targeting amanitin conjugates FOLH1, ANPEP, PSMA6 ALDH1A1 2847/4885TSHR 2131/4885MAPK1 4107/4885
US-10961177-B2 Process for preparing an anticorrosion component for an antifreeze POLA1, SCO2, OGDH ALDH1A1 867/4885TSHR 3588/4885MAPK1 798/4885

“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.