SCHEMBL6010396

SCHEMBL6010396

CC(=O)c1ccc2c(c1)C(=O)C=C(C)C2=O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ S100A4 P26447 2/20 0.57
▸ MAPT P10636 5/20 0.52
▸ KMT2A Q03164 5/20 0.52
▸ MEN1 O00255 4/20 0.52
▸ ALDH1A1 P00352 4/20 0.52
▸ MAPK1 P28482 3/20 0.52
▸ BLM P54132 3/20 0.52
▸ SMN1; SMN2 Q16637 3/20 0.52
▸ TP53 P04637 2/20 0.52
▸ CYP1A2 P05177 2/20 0.52
▸ CYP3A4 P08684 2/20 0.52
▸ HSPD1 P10809 2/20 0.52
▸ HPGD P15428 2/20 0.52
▸ CDC25A P30304 2/20 0.52
▸ CDC25B P30305 2/20 0.52
▸ HSPE1 P61604 2/20 0.52
▸ TST Q16762 2/20 0.52
▸ USP2 O75604 2/20 0.52
▸ GAA P10253 2/20 0.52
▸ MAOB P27338 2/20 0.52

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
SCHEMBL15855075 0.86 TTR (0.56) MAPTKMT2AMEN1ALDH1A1MAPK1
SCHEMBL15855076 0.82 PTPRC (0.54) MAPTKMT2AMEN1ALDH1A1MAPK1
SCHEMBL29223980 0.80 IDO1 (0.57) S100A4MAPTKMT2AMEN1ALDH1A1
SCHEMBL15855939 0.80 MAPT (0.55) MAPTKMT2AMEN1ALDH1A1MAPK1
SCHEMBL15855114 0.79 TTR (0.56) MAPTKMT2AMEN1ALDH1A1MAPK1
SCHEMBL11013388 0.77 ESR1 (0.57) MAPTKMT2AMEN1ALDH1A1MAPK1
SCHEMBL30004118 0.77 ESR1 (0.57) MAPTKMT2AMEN1ALDH1A1MAPK1
SCHEMBL15856048 0.76 PTPRC (0.63) MAPTKMT2AMEN1ALDH1A1MAPK1
SCHEMBL5820386 0.76 ALDH1A1 (0.61) MAPTKMT2AMEN1ALDH1A1MAPK1
SCHEMBL29223895 0.76 S100A4 (0.56) S100A4MAPTKMT2AALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150344404-A1 PDK4 INHIBITOR AND USE THEREOF THE KITASATO INSTITUTE (JP) 2015-12-03 — — US disclosed
EP-2939668-A1 PDK4 INHIBITOR AND USE THEREOF The Kitasato Institute (JP) 2015-11-04 — — EP disclosed
EP-2939668-A1 PDK4 INHIBITOR AND USE THEREOF The Kitasato Institute (JP) 2015-11-04 — — EP disclosed
WO-2014103321-A1 PDK4 INHIBITOR AND USE THEREOF 学校法人北里研究所 (JP) 2014-07-03 — — WO disclosed
US-7022721-B1 Method and composition for rejuvenating cells, tissues, organs, hair and nails ULRICH PETER C 2006-04-04 — — US disclosed
EP-1368029-A4 METHOD AND COMPOSITION FOR REJUVINATING CELLS, TISSUES, ORGANS, HAIR AND NAILS FARRINGTON PHARMACEUTICALS LLC (US) 2006-02-15 — — EP disclosed
US-20050245512-A1 Method and composition for rejuvinating cells, tissues organs, hair and nails ULRICH PETER C 2005-11-03 — — US disclosed
US-6777557-B2 Method and composition for rejuvenating cells, tissues organs, hair and nails FARRINGTON PHARMACEUTICALS, LLC 2004-08-17 — — US disclosed
US-6689777-B2 DEPOLYMERIZING HEMOZOIN USING 2-IMINO-NAPHTHO(1,2-D)THIAZOL-5-OL DERIVATIVES KENNETH S. WARREN INSTITUTE 2004-02-10 — — US disclosed
EP-1368029-A2 METHOD AND COMPOSITION FOR REJUVINATING CELLS, TISSUES, ORGANS, HAIR AND NAILS Farrington Pharmaceuticals, LLC (US) 2003-12-10 — — EP disclosed
US-20030186993-A1 Anti-malarial compounds, compositions and methods KENNETH S. WARREN INSTITUTE 2003-10-02 — — US disclosed
US-20020188015-A1 Method and composition for rejuvinating cells, tissues organs, hair and nails FARRINGTON PHARMACEUTICALS, LLC 2002-12-12 — — US disclosed
WO-2002062301-A2 METHOD AND COMPOSITION FOR REJUVINATING CELLS, TISSUES, ORGANS, HAIR AND NAILS FARRINGTON PHARMACEUTICALS, LLC (US) 2002-08-15 — — WO 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 (4 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-20020188015-A1 Method and composition for rejuvinating cells, tissues organs, hair and nails TERT, TELO2, HKDC1 S100A4 39/4885MAPT 1442/4885KMT2A 1145/4885
US-20050245512-A1 Method and composition for rejuvinating cells, tissues organs, hair and nails TERT, TELO2, HKDC1 S100A4 39/4885MAPT 1442/4885KMT2A 1145/4885
US-20030186993-A1 Anti-malarial compounds, compositions and methods TYR, CRYZ, RHOT2 S100A4 527/4885MAPT 309/4885KMT2A 2497/4885
US-20150344404-A1 PDK4 INHIBITOR AND USE THEREOF PDK4, PDK3, PDK2 S100A4 4579/4885MAPT 2524/4885KMT2A 1001/4885

“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.

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