SCHEMBL6551603

SCHEMBL6551603

OCC1CCC(CO)C(O)C1

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SLC18A3 Q16572 1/20 0.37
GBA1 P04062 7/20 0.33
SI P14410 1/20 0.33
PYGL P06737 1/20 0.33
GBA2 Q9HCG7 1/20 0.33
GAA P10253 1/20 0.33
GLB1 P16278 1/20 0.33
ESR1 P03372 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33
ESR2 Q92731 1/20 0.33
INPP5A Q14642 1/20 0.30
AGL P35573 1/20 0.30

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
SCHEMBL3480518 0.84 INPP5A (0.35) GBA1SIPYGLGBA2GAA
SCHEMBL3479935 0.81 CA1 (0.41) GBA1CYP2C9
SCHEMBL14964425 0.80 SLC18A3 (0.37) SLC18A3GBA1SIPYGLGBA2
SCHEMBL21846021 0.79 SLC18A3 (0.42) SLC18A3GBA2ESR1CYP3A4CYP2C9
SCHEMBL8727341 0.79 SLC18A3 (0.42) SLC18A3GBA2ESR1CYP3A4CYP2C9
SCHEMBL608227 0.79 INPP5A (0.37) SIESR1CYP3A4CYP2C9ESR2
SCHEMBL8727342 0.79 SLC18A3 (0.42) SLC18A3GBA2ESR1CYP3A4CYP2C9
SCHEMBL8027081 0.77 GBA1 (0.34) GBA1SIPYGLGBA2GAA
SCHEMBL6779275 0.75
SCHEMBL27228942 0.75

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
CN-110832611-B Additive for electrolytic capacitor and application thereof 三洋化成工业株式会社 2021-10-22 CN disclosed
EP-1484369-A1 UV-curable silk screen printing ink Marabuwerke GmbH & Co. KG (DE) 2004-12-08 EP disclosed
EP-0888279-A1 SELECTIVE CHEMICAL REACTIONS AND POLYMERS OF CONTROLLED ARCHITECTURE PRODUCED THEREBY COURTAULDS COATINGS (HOLDINGS) LIMITED (GB) 1999-01-07 EP disclosed
WO-1997023443-A1 SELECTIVE CHEMICAL REACTIONS AND POLYMERS OF CONTROLLED ARCHITECTURE PRODUCED THEREBY COURTAULDS COATINGS (HOLDINGS) LIMITED (GB) 1997-07-03 WO disclosed