SCHEMBL14206349

SCHEMBL14206349

BCc1ccc(C(=O)OC(C)=O)c(OC)c1C(=O)OC(C)=O

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 1/20 0.30
▸ TDP1 Q9NUW8 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ TSHR P16473 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
SCHEMBL6356661 0.88 DRD2 (0.34) MAPTTDP1ALDH1A1TSHR
SCHEMBL6354479 0.85 ALDH1A1 (0.31) MAPTTDP1ALDH1A1TSHR
SCHEMBL6356659 0.78 POLB (0.36) MAPTTDP1ALDH1A1
SCHEMBL8995838 0.71 POLB (0.40) MAPTALDH1A1TSHR
SCHEMBL5255903 0.66 CES2 (0.44) MAPTTDP1
SCHEMBL12636442 0.66 ALDH1A1 (0.47) ALDH1A1TSHR
SCHEMBL3089078 0.65 ALDH1A1 (0.47) ALDH1A1
SCHEMBL8995835 0.65 CA12 (0.49) MAPTALDH1A1TSHR
SCHEMBL6939779 0.64 KDM4E (0.40) TDP1ALDH1A1TSHR
SCHEMBL9255849 0.63 TSHR (0.36) TDP1ALDH1A1TSHR

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-2008063721-A2 LUMINESCENT MACROCYCLIC LANTHANIDE COMPLEXES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2008-05-29 — — WO disclosed
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