SCHEMBL2768779

SCHEMBL2768779

COc1ccc(CCCc2cccc(OCC(=O)O)c2)cc1OC

nearest known ligand 0.64

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 2/20 0.64
PPARG P37231 1/20 0.64
LMNA P02545 1/20 0.57
MTNR1A P48039 3/20 0.55
MTNR1B P49286 3/20 0.55
ALDH1A1 P00352 2/20 0.53
POLB P06746 2/20 0.53
SMN1; SMN2 Q16637 2/20 0.51
PLAAT3 P53816 1/20 0.51
PLAAT5 Q96KN8 1/20 0.51
PLAAT2 Q9NWW9 1/20 0.51
PLAAT4 Q9UL19 1/20 0.51
PTGDR2 Q9Y5Y4 3/20 0.51
PTGIR P43119 2/20 0.50
ABCB1 P08183 1/20 0.49
LPAR1 Q92633 1/20 0.48
LPAR2 Q9HBW0 1/20 0.48

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
SCHEMBL20463210 0.90 MTNR1A (0.55) PPARAPPARGLMNAMTNR1AMTNR1B
SCHEMBL2769878 0.89 PPARA (0.63) PPARAPPARGLMNAALDH1A1PTGDR2
SCHEMBL4587671 0.88 SMN1; SMN2 (0.57) LMNAALDH1A1POLBSMN1; SMN2PLAAT3
SCHEMBL10063439 0.86 MTNR1A (0.54) PPARAPPARGLMNAMTNR1AMTNR1B
SCHEMBL23193815 0.84 PPARA (0.58) PPARAPPARGLMNAPTGDR2PTGIR
SCHEMBL2769640 0.84 MTNR1A (0.50) PPARAPPARGLMNAMTNR1AMTNR1B
SCHEMBL23193851 0.84 LTA4H (0.46) PPARAPPARGLMNAALDH1A1SMN1; SMN2
SCHEMBL24782143 0.83 ALDH1A1 (0.58) LMNAMTNR1AMTNR1BALDH1A1POLB
SCHEMBL2769715 0.83 PPARA (0.74) PPARAPPARGLMNAPTGDR2PTGIR
SCHEMBL2768776 0.83 LMNA (0.52) PPARAPPARGLMNAALDH1A1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3256470-B1 METHODS TO INDUCE TARGETED PROTEIN DEGRADATION THROUGH BIFUNCTIONAL MOLECULES DANA FARBER CANCER INST INC (US) 2023-07-26 EP disclosed
US-20230063768-A1 IMMUNOPHILIN BINDING AGENTS AND USES THEREOF THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2023-03-02 US disclosed
WO-2021067439-A1 RAPAFUCIN DERIVATIVE COMPOUNDS AND METHODS OF USE THEREOF THE JOHNS HOPKINS UNIVERSITY (US) 2021-04-08 WO disclosed
US-20200308144-A1 Multimeric piperidine derivatives BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM 2020-10-01 US disclosed
WO-2020163594-A1 IMMUNOPHILIN BINDING AGENTS AND USES THEREOF THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2020-08-13 WO disclosed
EP-3030556-B1 SELECTIVE FKBP51 LIGANDS FOR TREATMENT OF PSYCHIATRIC DISORDERS UNIV DARMSTADT TECH (DE) 2019-10-30 EP disclosed
US-8436183-B2 Synthetic multimerizing agents ARIAD PHARMACEUTICALS, INC. (US) 2013-05-07 US disclosed
US-20120130076-A1 Synthetic Multimerizing Agents ARIAD PHARMACEUTICALS, INC. (US) 2012-05-24 US disclosed
WO-2010077317-A2 PROTEASE INHIBITORS AMPLYX PHARMACEUTICALS, INC. (US) 2010-07-08 WO disclosed
WO-2010065110-A2 ANTIMICROBIALS AMPLYX PHARMACEUTICALS, INC. (US) 2010-06-10 WO disclosed
EP-0888303-B1 SYNTHETIC DERIVATIVES OF RAPAMYCIN AS MULTIMERIZING AGENTS FOR CHIMERIC PROTEINS WITH IMMUNOPHILIN-DERIVED DOMAINS ARIAD PHARMA INC (US) 2010-04-21 EP disclosed
EP-0776327-B1 NEW MULTIMERIZING AGENTS ARIAD GENE THERAPEUTICS INC (US) 2005-07-06 EP disclosed
US-20040006233-A1 Synthetic multimerizing agents ARIAD PHARMACEUTICALS, INC. 2004-01-08 US disclosed
US-20030036654-A1 Synthetic multimerizing agents HOLT DENNIS A (US) 2003-02-20 US disclosed
US-20020161240-A1 Synthetic multimerizing agents ARIAD GENE THERAPEUTICS, INC. 2002-10-31 US disclosed
US-6150527-A Synthetic multimerizing agents ARIAD PHARMACEUTICALS, INC. (US) 2000-11-21 US disclosed
US-6133456-A DIMERS OF THE MACROCYCLIC NATURAL PRODUCT, FK506, COVALENTLY ATTACHED TO EACH OTHER VIA A SYNTHETIC LINKER MOIETY ARIAD GENE THERAPEUTICS, INC. (US) 2000-10-17 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-20020161240-A1 Synthetic multimerizing agents SSB, F13B, LCP2 PPARA 4812/4885PPARG 4748/4885LMNA 800/4885
US-20200308144-A1 Multimeric piperidine derivatives FKBP14, FKBP5, FKBP3 PPARA 1390/4885PPARG 2359/4885LMNA 3984/4885
US-20120130076-A1 Synthetic Multimerizing Agents FKBP1B, FKBP2, FKBP14 PPARA 4156/4885PPARG 3704/4885LMNA 3392/4885
US-20040006233-A1 Synthetic multimerizing agents FKBP1B, FKBP2, FKBP14 PPARA 4253/4885PPARG 3830/4885LMNA 3381/4885
US-20230063768-A1 IMMUNOPHILIN BINDING AGENTS AND USES THEREOF PMP22, MAG, FABP7 PPARA 3666/4885PPARG 3733/4885LMNA 3678/4885
US-20030036654-A1 Synthetic multimerizing agents FKBP1B, FKBP2, FKBP14 PPARA 4414/4885PPARG 3958/4885LMNA 4343/4885

“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.