SCHEMBL25866170

SCHEMBL25866170

CCCCCCCC(CCCCCCC)OC(=O)CCCCCCN(CCCCCCC(=O)OC(CCCCCCC)CCCCCCC)CC(O)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ASAH1 Q13510 2/20 0.47
KDM4E B2RXH2 1/20 0.46
PPARG P37231 2/20 0.44
MAPT P10636 1/20 0.44
MAPK1 P28482 1/20 0.44
CERT1 Q9Y5P4 3/20 0.43
TLR2 O60603 3/20 0.43
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
ALDH1A1 P00352 3/20 0.42
LMNA P02545 1/20 0.42
PPARA Q07869 1/20 0.42
ICMT O60725 1/20 0.42
ALB P02768 1/20 0.42
ACER2 Q5QJU3 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
SCHEMBL25864899 0.85 LMNA (0.40) PPARGMAPTMAPK1TLR2NPC1
SCHEMBL25416805 0.84 BCHE (0.50) MAPTMAPK1TLR2ALDH1A1LMNA
SCHEMBL25419410 0.83 MAPK1 (0.53) MAPTMAPK1ALDH1A1LMNA
SCHEMBL27372608 0.81 BCHE (0.47) MAPTMAPK1TLR2LMNA
SCHEMBL18971128 0.80 SIRT2 (0.49) TLR2ALDH1A1LMNAICMTALB
SCHEMBL26311136 0.80 MAPK1 (0.58) KDM4EMAPTMAPK1ALDH1A1LMNA
SCHEMBL25629202 0.80 MAPT (0.49) KDM4EMAPTMAPK1ALDH1A1LMNA
SCHEMBL22920335 0.80 MAPT (0.56) KDM4EMAPTMAPK1ALDH1A1LMNA
SCHEMBL27415249 0.80 MAPK1 (0.49) KDM4EMAPTMAPK1ALDH1A1LMNA
SCHEMBL11608689 0.79 LMNA (0.58) MAPTMAPK1SMN1; SMN2ALDH1A1LMNA

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-2023126006-A1 CATIONIC LIPID CONTAINING FUNCTIONAL GROUP ON SIDE CHAIN, AND USE THEREOF 厦门赛诺邦格生物科技股份有限公司 2023-07-06 WO disclosed