SCHEMBL3352406

SCHEMBL3352406

Cc1cc(C)c(Nc2c(C(C)C)cccc2C(C)C)c(C)c1

nearest known ligand 0.58

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
RAPGEF4 Q8WZA2 20/20 0.58

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
SCHEMBL2925868 0.86 MAPK1 (0.47)
SCHEMBL812723 0.83 GABRA1 (0.52)
SCHEMBL18734563 0.81 RAPGEF4 (0.56) RAPGEF4
SCHEMBL5670018 0.81 RAPGEF4 (0.40) RAPGEF4
SCHEMBL7943273 0.79 RAPGEF4 (0.61) RAPGEF4
SCHEMBL14168981 0.79 RAPGEF4 (0.75) RAPGEF4
SCHEMBL12152328 0.78 LMNA (0.40) RAPGEF4
SCHEMBL12076480 0.78 GABRA1 (0.43)
SCHEMBL30406436 0.78 KDM4E (0.46)
SCHEMBL13535527 0.76 GABRA1 (0.41)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9206107-B2 Method for producing carboxylic acid and alcohol by hydrolysis of ester NATIONAL UNIVERSITY CORPORATION NAGOYA UNIVERSITY (JP) 2015-12-08 US disclosed
US-20140378692-A1 METHOD FOR PRODUCING CARBOXYLIC ACID AND ALCOHOL BY HYDROLYSIS OF ESTER NATIONAL UNIVERSITY CORPORATION NAGOYA UNIVERSITY (JP) 2014-12-25 US disclosed
JP-2010209027-A PROCESS FOR PRODUCING ESTER BY DEHYDRATION CONDENSATION IN WATER NAGOYA UNIV 2010-09-24 JP disclosed
EP-1731498-B1 METHOD FOR PRODUCING ESTER AND ESTERIFICATION CATALYST INST NAGOYA IND SCIENCE RES (JP) 2010-05-19 EP disclosed
EP-1731498-A1 METHOD FOR PRODUCING ESTER AND ESTERIFICATION CATALYST Nagoya Industrial Science Research Institute (JP) 2006-12-13 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 (1 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-20140378692-A1 METHOD FOR PRODUCING CARBOXYLIC ACID AND ALCOHOL BY HYDROLYSIS OF ESTER ADH5, ADH1C, ADH1A RAPGEF4 2471/4885

“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.