SCHEMBL11097199

SCHEMBL11097199

CC1(C)[C@@H](OC(=O)O)[C@@H]1OC(=O)O

nearest known ligand 0.36

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
APLNR P35414 1/20 0.36

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
SCHEMBL10342515 1.00 APLNR (0.36) APLNR
SCHEMBL11147120 0.88 APLNR (0.34) APLNR
SCHEMBL11203953 0.78 APLNR (0.30) APLNR
SCHEMBL11294080 0.78 APLNR (0.30) APLNR
SCHEMBL10864195 0.76
SCHEMBL11207118 0.76
SCHEMBL10754289 0.76
SCHEMBL10782221 0.76
SCHEMBL11208680 0.74 HTT (0.36)
SCHEMBL11149467 0.74

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
EP-0099523-A2 Iodopropargyl esters of carboxylic acids BAYER AG (DE) 1984-02-01 EP claimed
EP-0021160-A1 Process for the preparation of trans-3,3-dimethyl-cyclopropane-1,2-dicarboxylic acid BAYER AG (DE) 1981-01-07 EP claimed
EP-0021114-B1 PROCESS FOR THE PREPARATION OF 2-CYANO-3,3-DIMETHYL-CYCLOPROPANE-1-CARBOXYLIC ACID ESTERS, INTERMEDIATES THEREFOR AND THEIR PRODUCTION BAYER AG (DE) 1983-05-18 EP disclosed
EP-0021115-A1 Process for the production of 3,3-dimethyl-cyclopropane-1,1,2-tricarboxylic acid derivatives, alpha-halogen nitriles as intermediates therefor and process for their production BAYER AG (DE) 1981-01-07 EP disclosed
EP-0021160-A1 Process for the preparation of trans-3,3-dimethyl-cyclopropane-1,2-dicarboxylic acid BAYER AG (DE) 1981-01-07 EP disclosed
EP-0021160-A1 Process for the preparation of trans-3,3-dimethyl-cyclopropane-1,2-dicarboxylic acid BAYER AG (DE) 1981-01-07 EP disclosed
EP-0021160-A1 Process for the preparation of trans-3,3-dimethyl-cyclopropane-1,2-dicarboxylic acid BAYER AG (DE) 1981-01-07 EP disclosed
EP-0021114-A1 Process for the preparation of 2-cyano-3,3-dimethyl-cyclopropane-1-carboxylic acid esters, intermediates therefor and their production BAYER AG (DE) 1981-01-07 EP disclosed