SCHEMBL3799604

SCHEMBL3799604

CC(CO)CC(C)(C)C(O)C(C)CC(=O)O

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.33
SLC22A6 Q4U2R8 1/20 0.32
PGD P52209 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL28170259 0.74 TRPA1 (0.39)
SCHEMBL3946943 0.74 SLC22A6 (0.42) MAPTSLC22A6PGDSMN1; SMN2
SCHEMBL726077 0.69
SCHEMBL43435 0.69
SCHEMBL426206 0.69
SCHEMBL841666 0.68 FOLH1 (0.35)
SCHEMBL7562855 0.68 SLC22A6 (0.43) MAPTSLC22A6SMN1; SMN2
SCHEMBL427442 0.67 KDM4E (0.45)
SCHEMBL11691733 0.67
SCHEMBL5157730 0.67

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-20100010132-A1 Additive for and a method of improving early resistance to driving rain of coating compositions HILTI AKTIENGESELLSCHAFT (LI) 2010-01-14 US claimed