SCHEMBL2170365

SCHEMBL2170365

CCCCCCN(CC)N([C]=O)CCC

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 3/20 0.38
MGLL Q99685 1/20 0.32
TSHR P16473 1/20 0.32
THRB P10828 1/20 0.32
S1PR2 O95136 1/20 0.32
S1PR1 P21453 1/20 0.32
S1PR3 Q99500 1/20 0.32
S1PR5 Q9H228 1/20 0.32
ADH1C P00326 1/20 0.32
ADH1A P07327 1/20 0.32
ADH4 P08319 1/20 0.32
CA12 O43570 2/20 0.31
CA1 P00915 2/20 0.31
CA9 Q16790 2/20 0.31
CA2 P00918 1/20 0.31
KDM5A P29375 2/20 0.30
PHF8 Q9UPP1 2/20 0.30
ZDHHC20 Q5W0Z9 1/20 0.30
ZDHHC2 Q9UIJ5 1/20 0.30
KDM4C Q9H3R0 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
SCHEMBL2173056 0.90 DNM1 (0.39) DNM1MGLLTSHRTHRBS1PR2
SCHEMBL3469248 0.83 CA1 (0.31) CA1
SCHEMBL7966489 0.75 CA1 (0.32) CA1
SCHEMBL28207402 0.75 DNM1 (0.55) DNM1MGLLTSHRTHRBCA12
SCHEMBL7968821 0.74 DNM1 (0.33) DNM1GGPS1
SCHEMBL11315672 0.73 DNM1 (0.52) DNM1MGLLTSHRTHRBCA12
SCHEMBL4107378 0.73 DNM1 (0.52) DNM1MGLLTSHRTHRBCA12
SCHEMBL30849151 0.73 DNM1 (0.52) DNM1MGLLTSHRTHRBCA12
SCHEMBL28311682 0.73 DNM1 (0.52) DNM1MGLLTSHRTHRBCA12
SCHEMBL28900685 0.73 DNM1 (0.52) DNM1MGLLTSHRTHRBCA12

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-2346474-A1 PULVERULENT STYLING COMPOSITION Henkel AG & Co. KGaA (DE) 2011-07-27 EP disclosed
WO-2010054980-A1 PULVERULENT STYLING COMPOSITION HENKEL AG & CO. KGAA (DE) 2010-05-20 WO disclosed