SCHEMBL2235540

SCHEMBL2235540

CCCCCCCCCCN(CCCCCCCCCC)C(O)CC

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 5/20 0.44
CA12 O43570 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA9 Q16790 1/20 0.40
TSHR P16473 1/20 0.38
THRB P10828 1/20 0.38
GBA1 P04062 1/20 0.38
GGPS1 O95749 3/20 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
SCHEMBL1091766 1.00 DNM1 (0.44) DNM1CA12CA1CA2CA9
SCHEMBL2240118 1.00 DNM1 (0.44) DNM1CA12CA1CA2CA9
SCHEMBL381552 1.00 DNM1 (0.44) DNM1CA12CA1CA2CA9
SCHEMBL381465 1.00 DNM1 (0.44) DNM1CA12CA1CA2CA9
SCHEMBL2237932 1.00 DNM1 (0.44) DNM1CA12CA1CA2CA9
SCHEMBL11815562 1.00 DNM1 (0.44) DNM1CA12CA1CA2CA9
SCHEMBL25263969 1.00 DNM1 (0.44) DNM1CA12CA1CA2CA9
Hydrochloric Acid SCHEMBL4666219 0.98 DNM1 (0.46) DNM1CA12CA1CA2CA9
SCHEMBL30230081 0.98 DNM1 (0.42) DNM1CA12CA1CA2CA9
SCHEMBL30229983 0.98 DNM1 (0.42) DNM1CA12CA1CA2CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011101348-A1 LUBRICATING OIL COMPOSITION SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V. (NL) 2011-08-25 WO disclosed
EP-0229340-B1 PROCESS FOR PRODUCING LIQUID, HIGHLY-CONCENTRATED AMINE OXIDES HOECHST AKTIENGESELLSCHAFT (DE) 1991-03-06 EP disclosed
EP-0229340-A1 Process for producing liquid, highly-concentrated amine oxides HOECHST AKTIENGESELLSCHAFT (DE) 1987-07-22 EP disclosed