SCHEMBL2465723

SCHEMBL2465723

C=CC(=O)CCCC1C(C)CCCC1(C)C

nearest known ligand 0.40

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
UGT2B7 P16662 5/20 0.40

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
SCHEMBL2706121 0.82 UGT2B7 (0.53) UGT2B7
SCHEMBL28679355 0.82 UGT2B7 (0.41) UGT2B7
SCHEMBL20547796 0.82 UGT2B7 (0.31) UGT2B7
SCHEMBL2463622 0.79 UGT2B7 (0.39) UGT2B7
SCHEMBL2469237 0.78 UGT2B7 (0.31) UGT2B7
SCHEMBL2706965 0.76 ALDH1A1 (0.40) UGT2B7
SCHEMBL1149570 0.75 UGT2B7 (0.38) UGT2B7
SCHEMBL2707186 0.75 UGT2B7 (0.51) UGT2B7
SCHEMBL7939563 0.75 UGT2B7 (0.49) UGT2B7
SCHEMBL7940649 0.75 UGT2B7 (0.49) UGT2B7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2370207-A1 HYDROGENATION OF ESTER, KETONE OR ALDEHYDE GROUPS WITH RUTHENIUM COMPLEXES HAVING A DI-AMINE AND A PHOSPHOROUS-NITROGEN BIDENTATE LIGAND Firmenich S.A. (CH) 2011-10-05 EP disclosed
WO-2010061350-A1 HYDROGENATION OF ESTER, KETONE OR ALDEHYDE GROUPS WITH RUTHENIUM COMPLEXES HAVING A DI-AMINE AND A PHOSPHOROUS-NITROGEN BIDENTATE LIGAND FIRMENICH SA (CH) 2010-06-03 WO disclosed