SCHEMBL11445643

SCHEMBL11445643

CCCCCCCCCCCCCCCCCC(=O)OC(I)CCCCCCCCCCCCCCCCC

nearest known ligand 0.62

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.62
MAPK1 P28482 1/20 0.62
LMNA P02545 4/20 0.61
ALDH1A1 P00352 1/20 0.54
PRKCA P17252 4/20 0.54
PRKCE Q02156 2/20 0.54
PRKCQ Q04759 2/20 0.54
PRKCD Q05655 2/20 0.54
DGKA P23743 1/20 0.50
KDM4E B2RXH2 1/20 0.49
DUSP3 P51452 1/20 0.49
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49

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
SCHEMBL4870901 1.00 MAPT (0.62) MAPTMAPK1LMNAALDH1A1PRKCA
SCHEMBL4872226 1.00 MAPT (0.62) MAPTMAPK1LMNAALDH1A1PRKCA
SCHEMBL27641925 0.94 MAPT (0.55) MAPTMAPK1LMNAALDH1A1PRKCA
SCHEMBL11406914 0.88 MAPT (0.49) MAPTMAPK1LMNAALDH1A1PRKCA
SCHEMBL31112989 0.87 MAPT (0.65) MAPTMAPK1LMNAALDH1A1PRKCA
SCHEMBL10875939 0.85 MAPT (0.61) MAPTMAPK1LMNAALDH1A1PRKCA
SCHEMBL10629189 0.85 MAPT (0.52) MAPTMAPK1LMNAALDH1A1PRKCA
SCHEMBL17812603 0.82 LMNA (0.68) MAPTMAPK1LMNAALDH1A1PRKCA
SCHEMBL17812522 0.82 LMNA (0.68) MAPTMAPK1LMNAALDH1A1PRKCA
SCHEMBL9954786 0.82 LMNA (0.68) MAPTMAPK1LMNAALDH1A1PRKCA

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-4186104-A Antifoam compositions WACKER-CHEMIE GMBH (DE) 1980-01-29 US disclosed