SCHEMBL6033006

SCHEMBL6033006

CCCCCCOC(O)CCC(C)C

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 1/20 0.42
USP2 O75604 1/20 0.40
SPHK1 Q9NYA1 2/20 0.40
HTT P42858 1/20 0.39
LPAR1 Q92633 4/20 0.37
LPAR3 Q9UBY5 4/20 0.37
LPAR2 Q9HBW0 1/20 0.37

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
SCHEMBL28294072 0.90 SPHK1 (0.42) DNM1USP2SPHK1HTT
SCHEMBL27695365 0.90 SPHK1 (0.42) DNM1USP2SPHK1HTT
SCHEMBL27925080 0.90 SPHK1 (0.42) DNM1USP2SPHK1HTT
SCHEMBL1465743 0.85 DNM1 (0.47) DNM1USP2SPHK1HTT
SCHEMBL23038695 0.85 DNM1 (0.47) DNM1USP2SPHK1HTTLPAR1
SCHEMBL23038685 0.85 DNM1 (0.47) DNM1USP2SPHK1HTTLPAR1
SCHEMBL725926 0.85 DNM1 (0.47) DNM1USP2SPHK1HTT
SCHEMBL21693799 0.85 DNM1 (0.47) DNM1USP2SPHK1HTT
SCHEMBL10879025 0.85 DNM1 (0.47) DNM1USP2SPHK1HTT
SCHEMBL11119607 0.85 DNM1 (0.47) DNM1USP2SPHK1HTT

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
EP-1666473-A1 CARBOXYLIC ACID COMPOUNDS AND MEDICINAL COMPOSITIONS CONTAINING THE SAME AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 2006-06-07 EP disclosed