SCHEMBL22157358

SCHEMBL22157358

CC=CCN(C)CCCCCC

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 3/20 0.46
S1PR2 O95136 1/20 0.41
S1PR1 P21453 1/20 0.41
S1PR3 Q99500 1/20 0.41
S1PR5 Q9H228 1/20 0.41
GGPS1 O95749 3/20 0.39
KDM5A P29375 5/20 0.39
KDM4C Q9H3R0 4/20 0.39
PHF8 Q9UPP1 2/20 0.39
EPHX2 P34913 3/20 0.38
EPHX1 P07099 1/20 0.37
ADH1B P00325 1/20 0.37
ADH1C P00326 1/20 0.37
ADH1A P07327 1/20 0.37
ADH4 P08319 1/20 0.37
ADH7 P40394 1/20 0.37
KDM5C P41229 1/20 0.36
KDM5B Q9UGL1 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
SCHEMBL28812180 1.00 DNM1 (0.46) DNM1S1PR2S1PR1S1PR3S1PR5
SCHEMBL15504868 0.98 DNM1 (0.42) DNM1S1PR2S1PR1S1PR3S1PR5
SCHEMBL22157399 0.98 DNM1 (0.42) DNM1S1PR2S1PR1S1PR3S1PR5
SCHEMBL22157368 0.91 KDM4C (0.35) DNM1S1PR2S1PR1S1PR3S1PR5
SCHEMBL12670715 0.91 KDM4C (0.35) DNM1S1PR2S1PR1S1PR3S1PR5
SCHEMBL11685302 0.89 DNM1 (0.52) DNM1S1PR2S1PR1S1PR3S1PR5
SCHEMBL11686808 0.89 DNM1 (0.52) DNM1S1PR2S1PR1S1PR3S1PR5
SCHEMBL11687687 0.89 DNM1 (0.52) DNM1S1PR2S1PR1S1PR3S1PR5
SCHEMBL10748699 0.89 DNM1 (0.52) DNM1S1PR2S1PR1S1PR3S1PR5
SCHEMBL19629142 0.83 DNM1 (0.46) DNM1S1PR2S1PR1S1PR3S1PR5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3884019-A1 HOME CARE COMPOSITIONS Colgate-Palmolive Company (US) 2021-09-29 EP disclosed
CN-113227340-A Home care compositions 高露洁-棕榄公司 2021-08-06 CN disclosed
US-11008533-B2 Home care compositions COLGATE-PALMOLIVE COMPANY (US) 2021-05-18 US disclosed
US-20200208081-A1 HOME CARE COMPOSITIONS COLGATE-PALMOLIVE COMPANY (US) 2020-07-02 US disclosed
WO-2020139335-A1 HOME CARE COMPOSITIONS COLGATE-PALMOLIVE COMPANY (US) 2020-07-02 WO disclosed