SCHEMBL9632841

SCHEMBL9632841

CCCCCCCCCCCC(=O)NC(N)CCCO

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FAAH O00519 3/20 0.56
MEN1 O00255 2/20 0.56
KMT2A Q03164 2/20 0.56
MAPK1 P28482 1/20 0.56
NOD1 Q9Y239 4/20 0.55
DNM1 Q05193 1/20 0.54
PLA2G2C Q5R387 1/20 0.50
HSP90AA1 P07900 1/20 0.47
PLA2G10 O15496 2/20 0.47
DEGS1 O15121 2/20 0.46
SLC6A5 Q9Y345 1/20 0.44
THRB P10828 1/20 0.43
ASAH1 Q13510 1/20 0.43
CETP P11597 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
SCHEMBL7209829 0.85 SLC6A5 (0.59) FAAHMEN1KMT2AMAPK1NOD1
SCHEMBL7215978 0.85 SLC6A5 (0.59) FAAHMEN1KMT2AMAPK1NOD1
SCHEMBL15313039 0.85 PLA2G2C (0.60) FAAHMEN1KMT2AMAPK1PLA2G2C
SCHEMBL7215943 0.85 SLC6A5 (0.59) FAAHMEN1KMT2AMAPK1NOD1
SCHEMBL27736241 0.84 MEN1 (0.52) FAAHMEN1KMT2AMAPK1NOD1
SCHEMBL6808296 0.83 NOD1 (0.72) FAAHMEN1KMT2AMAPK1NOD1
SCHEMBL117117 0.82 FAAH (0.63) FAAHMEN1KMT2AMAPK1NOD1
SCHEMBL115769 0.82 FAAH (0.63) FAAHMEN1KMT2AMAPK1NOD1
SCHEMBL115687 0.82 FAAH (0.63) FAAHMEN1KMT2AMAPK1NOD1
SCHEMBL248586 0.82 FAAH (0.63) FAAHMEN1KMT2AMAPK1NOD1

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-5162315-A Topical administration of diltiazem THERAPEUTIC PATCH RESEARCH N.V. 1992-11-10 US disclosed