SCHEMBL5038246

SCHEMBL5038246

CCOC(=O)CCc1c(C(C)(C)C)cc(O)cc1C(C)(C)C

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.46
ALDH1A1 P00352 3/20 0.46
GAA P10253 2/20 0.46
HPGD P15428 2/20 0.46
HSD17B10 Q99714 2/20 0.46
GLA P06280 1/20 0.46
CASP1 P29466 1/20 0.46
CASP7 P55210 1/20 0.46
CYP4F2 P78329 2/20 0.44
CYP4A11 Q02928 2/20 0.44
TSHR P16473 1/20 0.41
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA7 P43166 1/20 0.41
CA9 Q16790 1/20 0.41
CA14 Q9ULX7 1/20 0.41
NR1H2 P55055 1/20 0.40
NR1H3 Q13133 1/20 0.40
L3MBTL1 Q9Y468 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
SCHEMBL9837863 0.86 GAA (0.36) KDM4EALDH1A1GAAHPGDHSD17B10
SCHEMBL9319322 0.85 ALDH1A1 (0.40) ALDH1A1GAATDP1
SCHEMBL9067391 0.84 VCAM1 (0.46) KDM4EALDH1A1GAAHSD17B10TSHR
SCHEMBL29140996 0.83 DGKA (0.47) ALDH1A1GAA
SCHEMBL29140984 0.83 DGKA (0.47) ALDH1A1GAA
SCHEMBL25306694 0.83 DGKA (0.47) ALDH1A1GAA
SCHEMBL29140974 0.83 DGKA (0.47) ALDH1A1GAA
SCHEMBL29140958 0.83 DGKA (0.47) ALDH1A1GAA
SCHEMBL27872791 0.83 CYP4F2 (0.50) KDM4EALDH1A1GAAHPGDHSD17B10
SCHEMBL2431502 0.80 KDM4E (0.50) KDM4EALDH1A1GAAHPGDHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0284879-A2 Method of inhibiting interleukin-1 release MERRELL DOW PHARMACEUTICALS INC. (US) 1988-10-05 EP claimed
EP-1932544-B1 Compositions for treating a connective tissue of a mammalian host UNIV PITTSBURGH (US) 2013-08-28 EP disclosed
EP-1932544-A1 Gene transfer for treating a connective tissue of a mammalian host UNIVERSITY OF PITTSBURGH OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2008-06-18 EP disclosed
US-7037492-B2 Gene transfer for studying and treating a connective tissue of a mammalian host UNIVERSITY OF PITTSBURGH OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2006-05-02 US disclosed
US-20030220283-A1 Gene transfer for treating a connective tissue of a mammalian host UNIVERSITY OF PITTSBURGH OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2003-11-27 US disclosed
US-20030092684-A1 Compositions and methods for treating hemorrhagic virus infections and other disorders ANTIBODY SYSTEMS, INC. 2003-05-15 US disclosed
US-20020098168-A1 Gene transfer for studying and treating a connective tissue of a mammalian host UNIVERSITY OF PITTSBURGH OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION 2002-07-25 US disclosed
US-6413511-B1 INSERTION POLYPEPTIDES IN MAMMALS JOINTS UNIVERSITY OF PITTSBURGH OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION 2002-07-02 US disclosed
US-20020077276-A1 Compositions and methods for treating hemorrhagic virus infections and other disorders ANTIBODY SYSTEMS, INC. 2002-06-20 US disclosed
EP-1171163-A1 COMPOSITIONS CONTAINING TETRACYCLINES FOR TREATING HEMORRHAGIC VIRUS INFECTIONS AND OTHER DISORDERS Antibody Systems, Inc. (US) 2002-01-16 EP disclosed
EP-0563239-A1 A TRUNCATED INTERLEUKIN-1 RECEPTOR GENE FOR THE TREATMENT OF ARTHRITIS UNIVERSITY OF PITTSBURGH OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 1993-10-06 EP disclosed
WO-1992011359-A1 A TRUNCATED INTERLEUKIN-1 RECEPTOR GENE FOR THE TREATMENT OF ARTHRITIS UNIVERSITY OF PITTSBURGH OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 1992-07-09 WO disclosed
US-5034412-A Antiinflammatory agents, skin disorders, antidiabetic agents or antiatherosclerosis agents MERRELL DOW PHARMACUETICALS INC. (US) 1991-07-23 US disclosed
US-5034412-A Antiinflammatory agents, skin disorders, antidiabetic agents or antiatherosclerosis agents MERRELL DOW PHARMACUETICALS INC. (US) 1991-07-23 US disclosed
US-5011857-A Administering 2,4-di-isobutyl-6-(n,n-dimethylaminomethyl)-phenol; antiinflammatory agent, alleviating psoriasis, diabetes, atheroschlerosis MERRELL DOW PHARMACEUTICALS INC. (US) 1991-04-30 US disclosed
US-5011857-A Administering 2,4-di-isobutyl-6-(n,n-dimethylaminomethyl)-phenol; antiinflammatory agent, alleviating psoriasis, diabetes, atheroschlerosis MERRELL DOW PHARMACEUTICALS INC. (US) 1991-04-30 US disclosed
EP-0284879-A3 METHOD OF INHIBITING INTERLEUKIN-1 RELEASE MERRELL DOW PHARMACEUTICALS INC. (US) 1990-10-17 EP disclosed
US-4870101-A TETRAETHYLTHIURAM DISULFIDE MERRELL DOW PHARMACEUTICALS INC. (US) 1989-09-26 US disclosed
US-4870101-A TETRAETHYLTHIURAM DISULFIDE MERRELL DOW PHARMACEUTICALS INC. (US) 1989-09-26 US disclosed
EP-0284879-A2 Method of inhibiting interleukin-1 release MERRELL DOW PHARMACEUTICALS INC. (US) 1988-10-05 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 (2 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-20020077276-A1 Compositions and methods for treating hemorrhagic virus infections and other disorders IL1R1, TNF, IL1A KDM4E 4134/4885ALDH1A1 3850/4885GAA 4525/4885
US-20030092684-A1 Compositions and methods for treating hemorrhagic virus infections and other disorders CCL11, SSB, TNF KDM4E 3144/4885ALDH1A1 4340/4885GAA 4403/4885

“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.