SCHEMBL4255547

SCHEMBL4255547

COCOc1cc(/C=C/c2ccc(C#N)cc2)cc(OCOC)c1CC=C(C)C

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 4/20 0.53
PPARA Q07869 4/20 0.53
MAOA P21397 1/20 0.44
MAOB P27338 1/20 0.44
CYP19A1 P11511 6/20 0.42
PTGS2 P35354 4/20 0.42
ALOX5 P09917 4/20 0.42
PTGS1 P23219 1/20 0.37
ABCB1 P08183 3/20 0.36
PDPK1 O15530 1/20 0.36
TTR P02766 1/20 0.36
TUBB4A P04350 1/20 0.35
TUBB P07437 1/20 0.35
TUBA3C P0DPH7 1/20 0.35
TUBA1B P68363 1/20 0.35
TUBA4A P68366 1/20 0.35
TUBB4B P68371 1/20 0.35
TUBB3 Q13509 1/20 0.35
TUBB2A Q13885 1/20 0.35
TUBB8 Q3ZCM7 1/20 0.35

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
SCHEMBL4255550 1.00 PPARG (0.53) PPARGPPARAMAOAMAOBCYP19A1
SCHEMBL3674607 0.90 PPARG (0.69) PPARGPPARA
SCHEMBL3674601 0.90 PPARG (0.69) PPARGPPARA
SCHEMBL4267499 0.81 PTGS2 (0.50) MAOAMAOBCYP19A1PTGS2ALOX5
SCHEMBL4267496 0.81 PTGS2 (0.50) MAOAMAOBCYP19A1PTGS2ALOX5
SCHEMBL3669574 0.80 PTPN1 (0.46) MAOAMAOBCYP19A1PTGS2ALOX5
SCHEMBL3669572 0.80 PTPN1 (0.46) MAOAMAOBCYP19A1PTGS2ALOX5
SCHEMBL4255529 0.79 MAPT (0.53) MAOAMAOBCYP19A1PTGS2ALOX5
SCHEMBL4255525 0.79 MAPT (0.53) MAOAMAOBCYP19A1PTGS2ALOX5
SCHEMBL4267569 0.79 ALOX5 (0.51) MAOAMAOBCYP19A1PTGS2ALOX5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7629375-B2 Cytoprotective compounds, pharmaceutical and cosmetic formulations, and methods JOHNSON & JOHNSON CONSUMER COMPANIES, INC. (US) 2009-12-08 US disclosed
US-20060178356-A1 Cytoprotective compounds, pharmaceutical and cosmetic formulations, and methods GALILEO PHARMACEUTICALS, INC. 2006-08-10 US disclosed
EP-1435894-A4 CYTOPROTECTIVE COMPOUNDS, PHARMACEUTICAL AND COSMETIC FORMULATIONS, AND METHODS GALILEO PHARMACEUTICALS INC (US) 2005-07-06 EP disclosed
US-20050142155-A1 Cytoprotective compounds, pharmaceutical and cosmetic formulations, and methods JOHNSON & JOHNSON CONSUMER INC. 2005-06-30 US disclosed
US-20050113416-A1 Cytoprotective compounds, pharmaceutical and cosmetic formulations, and methods GALILEO PHARMACEUTICALS, INC. 2005-05-26 US disclosed
EP-1435894-A2 CYTOPROTECTIVE COMPOUNDS, PHARMACEUTICAL AND COSMETIC FORMULATIONS, AND METHODS Galileo Pharmaceuticals, Inc. (US) 2004-07-14 EP disclosed
US-20030073712-A1 Cytoprotective compounds, pharmaceutical and cosmetic formulations, and methods JOHNSON & JOHNSON CONSUMER COMPANIES, INC. 2003-04-17 US disclosed
WO-2003009807-A2 CYTOPROTECTIVE COMPOUNDS, PHARMACEUTICAL AND COSMETIC FORMULATIONS, AND METHODS GALILEO LABORATORIES, INC. (US) 2003-02-06 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-20050142155-A1 Cytoprotective compounds, pharmaceutical and cosmetic formulations, and methods HSF1, HMOX1, NQO1 PPARG 14/4885PPARA 54/4885MAOA 575/4885
US-20030073712-A1 Cytoprotective compounds, pharmaceutical and cosmetic formulations, and methods HSF1, HMOX1, NQO1 PPARG 14/4885PPARA 54/4885MAOA 575/4885
US-20050113416-A1 Cytoprotective compounds, pharmaceutical and cosmetic formulations, and methods HSF1, HMOX1, NQO1 PPARG 14/4885PPARA 54/4885MAOA 575/4885
US-20060178356-A1 Cytoprotective compounds, pharmaceutical and cosmetic formulations, and methods HSF1, HMOX1, NQO1 PPARG 14/4885PPARA 54/4885MAOA 575/4885

“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.