SCHEMBL8980908

SCHEMBL8980908

CC(C)(C)OC(=O)NC1(C(=O)O)CCCCCCCC1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FAAH O00519 9/20 0.39
BTK Q06187 1/20 0.37
GAA P10253 2/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
MAPK1 P28482 1/20 0.36
EPHX1 P07099 1/20 0.36
P2RX7 Q99572 1/20 0.35
TRPV1 Q8NER1 6/20 0.35
MAPT P10636 1/20 0.34
CTSL P07711 1/20 0.34
CTSB P07858 1/20 0.34
CTSS P25774 1/20 0.34
GHSR Q92847 1/20 0.34

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
SCHEMBL1012064 1.00 FAAH (0.39) FAAHBTKGAAMEN1KMT2A
SCHEMBL8981350 1.00 FAAH (0.39) FAAHBTKGAAMEN1KMT2A
SCHEMBL550992 1.00 FAAH (0.39) FAAHBTKGAAMEN1KMT2A
SCHEMBL496169 1.00 FAAH (0.39) FAAHBTKGAAMEN1KMT2A
SCHEMBL76966 0.98 BTK (0.38) FAAHBTKGAAMEN1KMT2A
SCHEMBL202837 0.95 BTK (0.38) FAAHBTKGAAMEN1KMT2A
SCHEMBL142219 0.91 MEN1 (0.39) BTKGAAMEN1KMT2AMAPK1
SCHEMBL27646197 0.87 GAA (0.37) FAAHBTKGAAMEN1KMT2A
SCHEMBL15116645 0.86 GAA (0.36) FAAHBTKGAAMEN1KMT2A
SCHEMBL2789711 0.85 GHSR (0.37) FAAHBTKGAAMEN1KMT2A

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-5543414-A VIRICIDES SYNTEX (USA) INC. (US) 1996-08-06 US disclosed