SCHEMBL13428206

SCHEMBL13428206

C=CC(COC(=O)CO)OC(=O)CO

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.32
MAPT P10636 1/20 0.32
KDM4E B2RXH2 1/20 0.30
DUSP3 P51452 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
PRKCA P17252 1/20 0.30
LMNA P02545 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
SCHEMBL14340037 0.79 PRKCA (0.31) PRKCA
SCHEMBL6744553 0.78 HTT (0.34) TSHR
SCHEMBL5689906 0.78 TSHR (0.35) TSHRMAPTKDM4EDUSP3MEN1
SCHEMBL5690286 0.75 LMNA (0.46) TSHRMAPTKDM4EDUSP3MEN1
SCHEMBL7596298 0.75 PRKCA (0.45) TSHRMAPTPRKCA
Propene SCHEMBL1069176 0.75 TSHR (0.41) TSHRMAPTPRKCA
SCHEMBL7716251 0.75 PRKCA (0.39) PRKCALMNA
Propene SCHEMBL11323390 0.75 TSHR (0.41) TSHRMAPTPRKCA
SCHEMBL7720134 0.73 ALDH1A1 (0.38) PRKCALMNA
SCHEMBL29517095 0.73 ALDH1A1 (0.47) PRKCALMNA

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
US-20100062361-A1 LIQUID DEVELOPING AGENT AND PROCESS FOR PRODUCING THE SAME IWASE KOJI 2010-03-11 US disclosed