SCHEMBL7698752

SCHEMBL7698752

C=C(C)[C@@]1(CO)C(=O)OC[C@H]1CCCC

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PRKCA P17252 3/20 0.33
TDP1 Q9NUW8 1/20 0.31
ELANE P08246 1/20 0.31

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
SCHEMBL7698775 0.76 GRM2 (0.30) ELANE
SCHEMBL9508162 0.69 TDP1 (0.35) TDP1
SCHEMBL22601282 0.63 ALDH1A1 (0.38) PRKCA
SCHEMBL11865670 0.59
SCHEMBL27172660 0.56 CYP1A2 (0.47) TDP1
SCHEMBL3852394 0.56
SCHEMBL14113502 0.56 MAPT (0.31)
SCHEMBL13680422 0.56
SCHEMBL13680421 0.56
SCHEMBL8394024 0.55 POLB (0.36)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2002028829-A2 PEPTIDE DEFORMYLASE INHIBITORS QUESTCOR PHARMACEUTICALS, INC. (US) 2002-04-11 WO disclosed