SCHEMBL8612995

SCHEMBL8612995

CCCCC(C)(C)OC(=O)C(=O)O

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.34
CA1 P00915 1/20 0.34
PAM P19021 2/20 0.33
ALOX15 P16050 1/20 0.33
AKR1B1 P15121 1/20 0.33
MAPK1 P28482 1/20 0.33
FDPS P14324 1/20 0.32
GPR84 Q9NQS5 2/20 0.32
PPARG P37231 2/20 0.32
PPARD Q03181 2/20 0.32
PPARA Q07869 2/20 0.32
ALDH1A1 P00352 1/20 0.32
TSHR P16473 1/20 0.32
SLC22A6 Q4U2R8 1/20 0.32
SLC22A8 Q8TCC7 1/20 0.32
TLR2 O60603 1/20 0.32
HDAC11 Q96DB2 1/20 0.32
TDP1 Q9NUW8 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
SCHEMBL8646937 0.89 CA1 (0.38) CA2CA1PAMFDPSALDH1A1
SCHEMBL213108 0.87 LMNA (0.36) ALDH1A1
SCHEMBL608106 0.83 CA2 (0.36) CA2CA1PAMALOX15AKR1B1
SCHEMBL18687137 0.82 ALDH1A1 (0.37) CA2CA1FDPSALDH1A1TSHR
Ammonia Solution, Strong SCHEMBL29208117 0.81 CA2 (0.35) CA2CA1PAMALOX15AKR1B1
SCHEMBL608105 0.80 CA1 (0.38) CA2CA1PAMFDPSALDH1A1
SCHEMBL703086 0.80 TSHR (0.47) CA2CA1FDPSALDH1A1TSHR
SCHEMBL28418969 0.79 AKR1B1 (0.34) PAMALOX15AKR1B1GPR84PPARG
SCHEMBL12060125 0.78 GAA (0.46) CA2CA1FDPSALDH1A1
SCHEMBL4532940 0.78 ALDH1A1 (0.38) ALDH1A1TSHRTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10844192-B2 Conjugated polymers comprising thermally cleavable oxalate pendant groups INNOVATION LAB GMBH (DE) 2020-11-24 US disclosed
EP-3357100-B1 CONJUGATED POLYMERS WITH THERMALLY SPLITTABLE OXALATE SIDE GROUPS INNOVATIONLAB GMBH (DE) 2019-06-19 EP disclosed
US-20180244893-A1 CONJUGATED POLYMERS COMPRISING THERMALLY CLEAVABLE OXALATE PENDANT GROUPS INNOVATIONLAB GMBH (DE) 2018-08-30 US disclosed
EP-3357100-A1 CONJUGATED POLYMERS COMPRISING THERMALLY CLEAVABLE OXALATE PENDANT GROUPS InnovationLab GmbH (DE) 2018-08-08 EP disclosed
US-5840785-A DEBINDING REACTION INJECTION MOLDING REACTION WITH METAL POWDERS AND IMPROVED RHEOLOGY MEGAMET INDUSTRIES (US) 1998-11-24 US disclosed
WO-1997037789-A1 MOLDING PROCESS FEEDSTOCK USING A COPPER TRIFLATE CATALYST MEGAMET INDUSTRIES (US) 1997-10-16 WO disclosed