SCHEMBL9791167

SCHEMBL9791167

CCCCCCCC(=O)N[C@@H](CC(=O)OO)C(=O)OO

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.51
MEN1 O00255 1/20 0.51
FAAH O00519 1/20 0.51
MAPK1 P28482 1/20 0.51
NOD1 Q9Y239 7/20 0.50
DNM1 Q05193 1/20 0.46
LPAR3 Q9UBY5 4/20 0.44
HSP90AA1 P07900 1/20 0.43
POLB P06746 1/20 0.43
PLA2G2C Q5R387 1/20 0.43
LPAR1 Q92633 2/20 0.43
CPT2 P23786 1/20 0.43
CPT1A P50416 1/20 0.43
CPT1B Q92523 1/20 0.43

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
SCHEMBL5974622 1.00 KMT2A (0.51) KMT2AMEN1FAAHMAPK1NOD1
SCHEMBL9791134 0.98 KMT2A (0.50) KMT2AMEN1FAAHMAPK1NOD1
SCHEMBL9157761 0.88 NOD1 (0.54) KMT2AMEN1FAAHMAPK1NOD1
SCHEMBL1401444 0.85 NOD1 (0.55) KMT2AMEN1FAAHMAPK1NOD1
SCHEMBL38281 0.84 NOD1 (0.60) KMT2AMEN1FAAHMAPK1NOD1
SCHEMBL1887336 0.84 NOD1 (0.60) KMT2AMEN1FAAHMAPK1NOD1
SCHEMBL8618539 0.83 KMT2A (0.53) KMT2AMEN1FAAHMAPK1NOD1
SCHEMBL8615495 0.83 KMT2A (0.53) KMT2AMEN1FAAHMAPK1NOD1
SCHEMBL8018121 0.83 KMT2A (0.53) KMT2AMEN1FAAHMAPK1NOD1
SCHEMBL8018119 0.83 KMT2A (0.53) KMT2AMEN1FAAHMAPK1NOD1

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-5066487-A Antiperspirant RHONE-POULENC CHIMIE (FR) 1991-11-19 US claimed