SCHEMBL28294072

SCHEMBL28294072

CCCCCCCCCCCCC(O)OCCCCCCC(C)C

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SPHK1 Q9NYA1 3/20 0.42
DNM1 Q05193 1/20 0.41
USP2 O75604 1/20 0.39
GPR84 Q9NQS5 4/20 0.38
FFAR1 O14842 1/20 0.38
HTT P42858 1/20 0.38
LMNA P02545 2/20 0.38
GMNN O75496 1/20 0.36
POLB P06746 1/20 0.36
CYP2D6 P10635 1/20 0.36
THPO P40225 1/20 0.36
MTOR P42345 1/20 0.36
BLM P54132 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
SCHEMBL27925080 1.00 SPHK1 (0.42) SPHK1DNM1USP2GPR84FFAR1
SCHEMBL27695365 1.00 SPHK1 (0.42) SPHK1DNM1USP2GPR84FFAR1
SCHEMBL73758 0.92 DNM1 (0.47) SPHK1DNM1USP2GPR84FFAR1
SCHEMBL11119607 0.92 DNM1 (0.47) SPHK1DNM1USP2GPR84FFAR1
SCHEMBL16475713 0.92 DNM1 (0.47) SPHK1DNM1USP2GPR84FFAR1
SCHEMBL1466584 0.92 DNM1 (0.47) SPHK1DNM1USP2GPR84FFAR1
SCHEMBL10879025 0.92 DNM1 (0.47) SPHK1DNM1USP2GPR84FFAR1
SCHEMBL725926 0.92 DNM1 (0.47) SPHK1DNM1USP2GPR84FFAR1
SCHEMBL21693799 0.92 DNM1 (0.47) SPHK1DNM1USP2GPR84FFAR1
SCHEMBL1465743 0.92 DNM1 (0.47) SPHK1DNM1USP2GPR84FFAR1

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
CN-109651436-A Ionic liquid, ionic liquid loaded Raney nickel and catalysis n-butene or the method for mixing C4 oligomerisation 万华化学集团股份有限公司 2019-04-19 CN disclosed