SCHEMBL18151522

SCHEMBL18151522

O=C(O)CCC(O)COCCOCCOCCOCCOCCOCCOCCS

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 7/20 0.40
ANPEP P15144 4/20 0.40
ENPEP Q07075 4/20 0.40
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C19 P33261 1/20 0.39
TET2 Q6N021 3/20 0.36
KDM4A O75164 2/20 0.36
KDM4C Q9H3R0 2/20 0.36
KDM2A Q9Y2K7 2/20 0.36
TET3 O43151 1/20 0.36
PLA2G2C Q5R387 1/20 0.34
ALDH1A1 P00352 1/20 0.33
GAA P10253 1/20 0.33
ACE P12821 1/20 0.32

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
SCHEMBL29790257 0.84 MEN1 (0.41) FOLH1ANPEPENPEPCYP1A2CYP3A4
SCHEMBL28038601 0.80 TET2 (0.48) FOLH1ANPEPENPEPCYP1A2CYP3A4
Succinic Acid SCHEMBL4735296 0.77 FOLH1 (0.43) FOLH1ENPEPCYP1A2CYP3A4CYP2C19
SCHEMBL39838 0.76 FOLH1 (0.44) FOLH1ANPEPENPEPALDH1A1ACE
SCHEMBL13907082 0.76 FOLH1 (0.44) FOLH1ANPEPENPEPALDH1A1ACE
SCHEMBL30505307 0.76 FOLH1 (0.44) FOLH1ANPEPENPEPALDH1A1ACE
SCHEMBL12092215 0.76 FOLH1 (0.44) FOLH1ANPEPENPEPALDH1A1ACE
SCHEMBL40095 0.76 FOLH1 (0.44) FOLH1ANPEPENPEPALDH1A1ACE
SCHEMBL6366305 0.74
Mercaptopropionic Acid SCHEMBL331255 0.74 ACE (0.50) FOLH1ANPEPENPEPALDH1A1ACE

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-3819018-A1 FORWARD OSMOSIS DRAW SOLUTE Nanogap Sub NM Powder, S.A. (ES) 2021-05-12 EP disclosed
EP-3077476-B1 NANOCRYSTALS COMPLEXED WITH FUNCTIONALIZABLE ENHANCED AFFINITY LIGANDS AND USE THEREOF NEXDOT (FR) 2020-02-12 EP disclosed
US-10465030-B2 Nanoparticles complexed with functionalizable enhanced affinity ligands and use thereof NEXDOT (FR) 2019-11-05 US disclosed
US-20160304648-A1 NANOPARTICLES COMPLEXED WITH FUNCTIONALIZABLE ENHANCED AFFINITY LIGANDS AND USE THEREOF NEXDOT (FR) 2016-10-20 US disclosed