SCHEMBL18924864

SCHEMBL18924864

CCCCCCN(CCCCCC)C(=O)OC(CC)C(C)C

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.40
CA12 O43570 3/20 0.38
CA1 P00915 3/20 0.38
CA9 Q16790 3/20 0.38
CA2 P00918 1/20 0.38
ABCB1 P08183 1/20 0.36
ZDHHC20 Q5W0Z9 2/20 0.36
ZDHHC2 Q9UIJ5 1/20 0.36
MGLL Q99685 1/20 0.35
CES2 O00748 1/20 0.34
ZDHHC7 Q9NXF8 1/20 0.34
MAPT P10636 1/20 0.34
MAPK1 P28482 1/20 0.34
FAAH O00519 1/20 0.33
EPHX1 P07099 1/20 0.33

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
SCHEMBL6896156 0.83 LMNA (0.42) LMNACA12CA1CA9CA2
SCHEMBL14870606 0.83 LMNA (0.42) LMNACA12CA1CA9CA2
SCHEMBL14870614 0.83 LMNA (0.42) LMNACA12CA1CA9CA2
SCHEMBL6895826 0.83 LMNA (0.42) LMNACA12CA1CA9CA2
SCHEMBL14870615 0.83 LMNA (0.42) LMNACA12CA1CA9CA2
SCHEMBL14870608 0.83 LMNA (0.42) LMNACA12CA1CA9CA2
SCHEMBL12507254 0.82 LMNA (0.53) LMNACA12CA1CA9CA2
SCHEMBL7522458 0.78 FAAH (0.51) LMNACA12CA1CA9CA2
SCHEMBL8989555 0.78 FAAH (0.51) LMNACA12CA1CA9CA2
SCHEMBL8968820 0.78 FAAH (0.51) LMNACA12CA1CA9CA2

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
US-9670200-B2 Quaternary ammonium salt prodrugs ALKERMES PHARMA IRELAND LIMITED (IE) 2017-06-06 US disclosed