SCHEMBL24836233

SCHEMBL24836233

CCCCCCCCCCCCCCN(CCCCCCCCCCCCCC)CCC(C)(C)OCCC(C)(C)OC

nearest known ligand 0.31

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 3/20 0.31
KCNH2 Q12809 1/20 0.31
SPHK2 Q9NRA0 1/20 0.31
CA12 O43570 1/20 0.30
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
CA9 Q16790 1/20 0.30

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
SCHEMBL24835690 0.94 DNM1 (0.31) DNM1CA12CA1CA2CA9
SCHEMBL20904581 0.84 SMPD1 (0.33) DNM1KCNH2SPHK2
SCHEMBL24835898 0.77 CA12 (0.35) DNM1CA12CA1CA2CA9
SCHEMBL21324044 0.75 CA12 (0.36) DNM1CA12CA1CA2CA9
SCHEMBL22421666 0.75 CA12 (0.36) DNM1CA12CA1CA2CA9
SCHEMBL24836047 0.75 CA12 (0.36) DNM1CA12CA1CA2CA9
SCHEMBL11136735 0.74 ALDH1A1 (0.42)
SCHEMBL25129127 0.73 CA12 (0.37) DNM1SPHK2CA12CA1CA2
SCHEMBL16789939 0.70 ALDH1A1 (0.36)
SCHEMBL15267587 0.70

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-2023273364-A1 POLYETHYLENE GLYCOL LIPID AND USE THEREOF 天津键凯科技有限公司 2023-01-05 WO disclosed