SCHEMBL945896

SCHEMBL945896

CCCCCC(O)(O)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FDPS P14324 9/20 0.46
GGPS1 O95749 6/20 0.46
AKR1B1 P15121 1/20 0.44
CES2 O00748 1/20 0.43
GPR84 Q9NQS5 2/20 0.42
PPARG P37231 2/20 0.42
PPARD Q03181 2/20 0.42
PPARA Q07869 2/20 0.42
ALDH1A1 P00352 1/20 0.42
TSHR P16473 1/20 0.42
SLC22A6 Q4U2R8 1/20 0.42
SLC22A8 Q8TCC7 1/20 0.42
TLR2 O60603 1/20 0.42
HDAC11 Q96DB2 1/20 0.42
TDP1 Q9NUW8 1/20 0.42

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
SCHEMBL6056853 0.98 FDPS (0.48) FDPSGGPS1CES2GPR84PPARG
SCHEMBL6056832 0.98 FDPS (0.48) FDPSGGPS1CES2GPR84PPARG
SCHEMBL7172854 0.98 FDPS (0.48) FDPSGGPS1CES2GPR84PPARG
SCHEMBL6230681 0.98 FDPS (0.45) FDPSGGPS1AKR1B1CES2GPR84
SCHEMBL6056892 0.98 FDPS (0.48) FDPSGGPS1CES2GPR84PPARG
SCHEMBL5502576 0.98 FDPS (0.45) FDPSGGPS1AKR1B1CES2GPR84
SCHEMBL1990820 0.98 FDPS (0.48) FDPSGGPS1CES2GPR84PPARG
SCHEMBL1916481 0.98 FDPS (0.48) FDPSGGPS1CES2GPR84PPARG
SCHEMBL6056814 0.98 FDPS (0.48) FDPSGGPS1CES2GPR84PPARG
SCHEMBL6056806 0.98 FDPS (0.48) FDPSGGPS1CES2GPR84PPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230116399-A1 Tumor Homing Statin Derivatives Da Zen Theranostics, Inc. (US) 2023-04-13 US claimed
CN-114686092-A Photocureable coating capable of being used for metal protection and preparation method thereof 中海油常州涂料化工研究院有限公司 2022-07-01 CN claimed
US-20210008217-A1 Tumor Homing Statin Derivatives Da Zen Theranostics, Inc. (US) 2021-01-14 US claimed
EP-3763389-A1 TUMOR HOMING STATIN DERIVATIVES Da Zen Theranostics Inc. (US) 2021-01-13 EP claimed
CN-111068064-A Composition comprising fatty acid or derivative thereof and dihydroxyheptanoic acid derivative 黄泳华 2020-04-28 CN claimed
CN-110590638-A Tumor-targeted statin derivative, pharmaceutical formulation and application 德珍(中国)医疗科技有限公司 2019-12-20 CN claimed
US-20140080788-A1 NOVEL BICYCLIC NITROGEN CONTAINING HETEROARYL TGR5 RECEPTOR MODULATORS BRISTOL-MYERS SQUIBB COMPANY 2014-03-20 US claimed
WO-2006059210-A2 FUSED BICYCLIC PYRROLS AS HMG-COA REDUCTASE INHIBITORS WARNER-LAMBERT COMPANY LLC (US) 2006-06-08 WO claimed
EP-1656132-A2 NOVEL PYRROLE-BASED HMG-COA REDUCTASE INHIBITORS Warner-Lambert Company LLC (US) 2006-05-17 EP claimed
EP-1625223-A2 CHEMOENZYMATIC METHODS FOR THE SYNTHESIS OF STATINS AND STATIN INTERMEDIATES Diversa Corporation (US) 2006-02-15 EP claimed
WO-2005014539-A2 PYRROLE-BASED HMG-COA REDUCTASE INHIBITORS WARNER-LAMBERT COMPANY LLC (US) 2005-02-17 WO claimed
WO-2004027075-A2 CHEMOENZYMATIC METHODS FOR THE SYNTHESIS OF STATINS AND STAIN INTERMEDIATES DIVERSA CORPORATION (US) 2004-04-01 WO claimed
JP-2003518086-A 2003-06-03 JP claimed
EP-1242365-A1 ACYL PSEUDODIPEPTIDES WHICH CARRY A FUNCTIONALISED AUXILIARY ARM OM Pharma (CH) 2002-09-25 EP claimed
WO-2001046126-A1 ACYL PSEUDODIPEPTIDES WHICH CARRY A FUNCTIONALISED AUXILIARY ARM OM PHARMA (CH) 2001-06-28 WO claimed
EP-0494120-A1 HMG-CoA reductase inhibitors BRITISH BIO-TECHNOLOGY LIMITED (GB) 1992-07-08 EP claimed
EP-0480986-A1 6-(HYDRONAPHTYL-1-ETHYL)-4-HYDROXY-3,4,5,6-TETRAHYDRO-2H-PYRAN-2-ONES AND THE CORRESPONDING HYDROXY ACIDS BRITISH BIO-TECHNOLOGY LIMITED (GB) 1992-04-22 EP claimed
US-4775681-A Method of treating fungal infections with trans-6-[2-substitutedpyrrol-1-yl)alkyl]-4-hydroxypyran-2-ones WARNER-LAMBERT COMPANY (US) 1988-10-04 US claimed
EP-0047693-B1 PROCESS FOR THE PREPARATION OF HYDROXYARYLGLYOXYLIC ACIDS AND THEIR ALKALI SALTS, AND THEIR USE IN THE PREPARATION OF SODIUM-PARA-HYDROXYPHENYL GLYOXYLATE SOCIETE FRANCAISE HOECHST Société anonyme dite: (FR) 1984-02-15 EP claimed
US-4384137-A CATALYTIC OXIDATION WITH CUPRIC IONS SOCIETE FRANCAISE HOECHST (FR) 1983-05-17 US 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-20230116399-A1 Tumor Homing Statin Derivatives HMGCR, DHCR7, DHODH FDPS 669/4885GGPS1 662/4885AKR1B1 1594/4885
US-20140080788-A1 NOVEL BICYCLIC NITROGEN CONTAINING HETEROARYL TGR5 RECEPTOR MODULATORS GRK5, GPBAR1, GPR55 FDPS 3319/4885GGPS1 840/4885AKR1B1 708/4885
US-20210008217-A1 Tumor Homing Statin Derivatives HMGCR, DHCR7, DHODH FDPS 669/4885GGPS1 662/4885AKR1B1 1594/4885

“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.