SCHEMBL9063789

SCHEMBL9063789

CCCCCCCCNCC(O)CCCCCCCCC(=O)NC

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FAAH O00519 8/20 0.51
FFAR4 Q5NUL3 1/20 0.49
FFAR1 O14842 1/20 0.49
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
GPR84 Q9NQS5 5/20 0.43
MAPK1 P28482 1/20 0.42
HSP90AA1 P07900 1/20 0.42
ANPEP P15144 1/20 0.41
ERAP2 Q6P179 1/20 0.41
NFKB1 P19838 1/20 0.41

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
SCHEMBL1289275 0.86 FAAH (0.66) FAAHFFAR4FFAR1MEN1KMT2A
SCHEMBL29150180 0.85 FFAR4 (0.70) FAAHFFAR4FFAR1MEN1KMT2A
SCHEMBL8376232 0.85 FFAR4 (0.51) FAAHFFAR4FFAR1MEN1KMT2A
SCHEMBL9063816 0.85 FFAR4 (0.70) FAAHFFAR4FFAR1MEN1KMT2A
SCHEMBL17199795 0.84 ANPEP (0.49) FAAHFFAR4FFAR1GPR84ANPEP
SCHEMBL7320330 0.84 ANPEP (0.49) FAAHFFAR4FFAR1GPR84ANPEP
SCHEMBL13833063 0.84 ANPEP (0.49) FAAHFFAR4FFAR1GPR84ANPEP
SCHEMBL11677240 0.84 ANPEP (0.49) FAAHFFAR4FFAR1GPR84ANPEP
SCHEMBL1270381 0.84 ANPEP (0.49) FAAHFFAR4FFAR1GPR84ANPEP
SCHEMBL16859680 0.84 ANPEP (0.49) FAAHFFAR4FFAR1GPR84ANPEP

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0719267-A1 SECOND MESSENGER CELL SIGNALING INHIBITORS CELL THERAPEUTICS, INC. (US) 1996-07-03 EP disclosed
EP-0719267-A4 SECOND MESSENGER CELL SIGNALING INHIBITORS CELL THERAPEUTICS INC (US) 1996-02-16 EP disclosed
WO-1994022863-A9 SECOND MESSENGER CELL SIGNALING INHIBITORS 1994-12-22 WO disclosed
WO-1994022863-A1 SECOND MESSENGER CELL SIGNALING INHIBITORS CELL THERAPEUTICS, INC. (US) 1994-10-13 WO disclosed