SCHEMBL28690865

SCHEMBL28690865

CCCCCOC(=O)CC(C(C)=O)C(=O)OCCCCC

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.53
NPSR1 Q6W5P4 2/20 0.50
MAPT P10636 1/20 0.50
MAPK1 P28482 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
RAD52 P43351 1/20 0.50
FAAH O00519 1/20 0.45
TSHR P16473 2/20 0.44
DGKA P23743 1/20 0.44
ALDH1A1 P00352 1/20 0.44
HTR2C P28335 1/20 0.44
LMNA P02545 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
HTT P42858 1/20 0.42
EPHX1 P07099 1/20 0.42
PRSS1 P07477 1/20 0.40
PRSS2 P07478 1/20 0.40
PRSS3 P35030 1/20 0.40
HCAR2 Q8TDS4 1/20 0.40

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
SCHEMBL11789053 0.95 ALDH1A1 (0.50) NAAANPSR1MAPTMAPK1L3MBTL1
SCHEMBL8751382 0.87 ALDH1A1 (0.54) NAAANPSR1MAPTMAPK1L3MBTL1
SCHEMBL11114076 0.85 ALDH1A1 (0.50) NAAANPSR1MAPTMAPK1L3MBTL1
SCHEMBL28076385 0.83 TSHR (0.48) NAAANPSR1MAPK1RAD52FAAH
SCHEMBL28322945 0.81 NAAA (0.52) NAAANPSR1RAD52FAAHTSHR
SCHEMBL28111137 0.81 NAAA (0.52) NAAANPSR1RAD52FAAHTSHR
SCHEMBL13082073 0.81 ALDH1A1 (0.52) NAAANPSR1MAPTMAPK1L3MBTL1
SCHEMBL14763962 0.81 NAAA (0.52) NAAANPSR1RAD52FAAHTSHR
SCHEMBL8045725 0.81 NAAA (0.52) NAAANPSR1RAD52FAAHTSHR
SCHEMBL12630085 0.80 TDP1 (0.38) NAAAMAPK1L3MBTL1TSHRDGKA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114044803-B Acetyl hexapeptide-1 derivative and application thereof 浙江湃肽生物有限公司深圳分公司 2022-04-12 CN disclosed
CN-114044803-A Acetyl hexapeptide-1 derivative and application thereof 浙江湃肽生物有限公司深圳分公司 2022-02-15 CN disclosed