SCHEMBL5575605

SCHEMBL5575605

CCCCCCCCCCCCC[C@H](N=C=O)C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.53
GPR84 Q9NQS5 7/20 0.50
FFAR1 O14842 2/20 0.50
LCK P06239 1/20 0.48
PPARD Q03181 1/20 0.48
ZDHHC20 Q5W0Z9 1/20 0.48
ZDHHC2 Q9UIJ5 1/20 0.48
ACE2 Q9BYF1 1/20 0.46
GRIK1 P39086 2/20 0.42
GRIK2 Q13002 2/20 0.42
FFAR4 Q5NUL3 1/20 0.42
SLC1A2 P43004 1/20 0.40
SLC1A1 P43005 1/20 0.40
HSPD1 P10809 1/20 0.39
BLM P54132 1/20 0.39
HSPE1 P61604 1/20 0.39
CA2 P00918 1/20 0.39
NOD1 Q9Y239 1/20 0.39

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
SCHEMBL11856369 1.00 MAPT (0.53) MAPTGPR84FFAR1LCKPPARD
SCHEMBL592033 0.92 CA2 (0.45) MAPTGPR84FFAR1LCKPPARD
SCHEMBL4906428 0.92 CA2 (0.45) MAPTGPR84FFAR1LCKPPARD
Hydrochloric Acid SCHEMBL8862325 0.91 CA2 (0.44) MAPTGPR84FFAR1LCKPPARD
SCHEMBL11395026 0.90 MAPT (0.38) MAPTGPR84FFAR1LCKPPARD
SCHEMBL11403455 0.88 MAPT (0.34) MAPTGPR84FFAR1LCKPPARD
SCHEMBL6101629 0.84 CHRM1 (0.44) MAPTGPR84FFAR1LCKPPARD
SCHEMBL11396426 0.84 MAPT (0.33) MAPTBLM
SCHEMBL5420724 0.84 MAPT (0.43) MAPTGPR84FFAR1LCKPPARD
SCHEMBL30576831 0.83 CA2 (0.38) MAPTGPR84FFAR1LCKPPARD

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-2007019478-A2 DRUG DELIVERY FROM IMPLANTS USING SELF-ASSEMBLED MONOLAYERS - THERAPEUTIC SAMS BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2007-02-15 WO disclosed