SCHEMBL6067582

SCHEMBL6067582

CCCCCCC(=O)C(C)C(=O)OCC

nearest known ligand 0.62

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CES2 O00748 1/20 0.52
MAPT P10636 1/20 0.49
LMNA P02545 2/20 0.48
MEN1 O00255 1/20 0.48
FAAH O00519 1/20 0.48
MAPK1 P28482 1/20 0.48
KMT2A Q03164 1/20 0.48
DGKA P23743 1/20 0.47

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
SCHEMBL3821988 0.98 CES2 (0.48) CES2MAPTLMNAMEN1FAAH
SCHEMBL6416630 0.92 CES2 (0.41) CES2MAPTLMNAMEN1FAAH
SCHEMBL6591638 0.85 MEN1 (0.53) CES2MAPTLMNAMEN1FAAH
SCHEMBL9074143 0.85 MEN1 (0.53) CES2MAPTLMNAMEN1FAAH
SCHEMBL4939835 0.84 ALDH1A1 (0.40) CES2LMNAKMT2A
SCHEMBL2989445 0.83 CES2 (0.64) CES2MEN1FAAHMAPK1KMT2A
SCHEMBL11509841 0.83 CES2 (0.64) CES2MEN1FAAHMAPK1KMT2A
SCHEMBL11852256 0.83 KMT2A (0.36) CES2MAPTKMT2A
SCHEMBL10541848 0.82 MEN1 (0.50) CES2MAPTLMNAMEN1FAAH
SCHEMBL28302659 0.81 CES2 (0.48) CES2MAPTLMNAMEN1FAAH

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
WO-2006100606-A2 PREPARATION OF BETA-AMINO ACID PRECURSORS VIA INDIUM (III) MEDIATED MARKOVNIKOV ADDITION AND KNOEVENAGEL CONDENSATION WARNER-LAMBERT COMPANY LLC (US) 2006-09-28 WO disclosed