SCHEMBL30229983

SCHEMBL30229983

CCCCCCCN(CCCC)C(O)CC

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 5/20 0.42
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA9 Q16790 1/20 0.39
GBA1 P04062 1/20 0.36
TSHR P16473 1/20 0.36
THRB P10828 1/20 0.36
GGPS1 O95749 3/20 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
SCHEMBL30230081 1.00 DNM1 (0.42) DNM1CA12CA1CA2CA9
SCHEMBL2235540 0.98 DNM1 (0.44) DNM1CA12CA1CA2CA9
SCHEMBL381465 0.98 DNM1 (0.44) DNM1CA12CA1CA2CA9
SCHEMBL30229787 0.98 DNM1 (0.39) DNM1CA12CA1CA2CA9
SCHEMBL11815562 0.98 DNM1 (0.44) DNM1CA12CA1CA2CA9
SCHEMBL25263969 0.98 DNM1 (0.44) DNM1CA12CA1CA2CA9
SCHEMBL2237932 0.98 DNM1 (0.44) DNM1CA12CA1CA2CA9
SCHEMBL1091766 0.98 DNM1 (0.44) DNM1CA12CA1CA2CA9
SCHEMBL381552 0.98 DNM1 (0.44) DNM1CA12CA1CA2CA9
SCHEMBL2240118 0.98 DNM1 (0.44) 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
EP-4127118-B1 WATER-GLYCOL HYDRAULIC FLUID COMPOSITION AND SUPPLEMENTARY ADDITIVE THEREFOR SHELL INT RESEARCH (NL) 2023-12-06 EP disclosed
US-20230144254-A1 WATER-GLYCOL HYDRAULIC FLUID COMPOSITION AND SUPPLEMENTARY ADDITIVE THEREFOR SHELL USA, INC. 2023-05-11 US disclosed
EP-4127118-A1 WATER-GLYCOL HYDRAULIC FLUID COMPOSITION AND SUPPLEMENTARY ADDITIVE THEREFOR Shell Internationale Research Maatschappij B.V. (NL) 2023-02-08 EP disclosed