SCHEMBL16637755

SCHEMBL16637755

CCn1c(=O)[nH]c2sc(OC(=O)O)c(C)c2c1=O

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA2B P29275 6/20 0.35
ALDH1A1 P00352 7/20 0.34
LMNA P02545 2/20 0.34
HTT P42858 2/20 0.34
MAPT P10636 2/20 0.34
RXFP1 Q9HBX9 1/20 0.34
KMT2A Q03164 5/20 0.33
MEN1 O00255 4/20 0.33
POLB P06746 3/20 0.33
CYP2C9 P11712 2/20 0.33
HPGD P15428 2/20 0.33
CYP1A2 P05177 2/20 0.33
ADORA2A P29274 2/20 0.32
ADORA3 P0DMS8 2/20 0.32
ACACB O00763 1/20 0.32
ACACA Q13085 1/20 0.32
ADORA1 P30542 1/20 0.32
PDE4A P27815 1/20 0.31
PDE4B Q07343 1/20 0.31
PDE4C Q08493 1/20 0.31

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
SCHEMBL5130407 0.81 ALDH1A1 (0.41) ADORA2BALDH1A1LMNAHTTMAPT
SCHEMBL5131623 0.78 QPCT (0.44) ADORA2BALDH1A1LMNAHTTRXFP1
SCHEMBL5132729 0.78 ALDH1A1 (0.40) ADORA2BALDH1A1LMNAHTTMAPT
SCHEMBL5032099 0.77 MAPT (0.47) ADORA2BALDH1A1LMNAHTTMAPT
SCHEMBL5033927 0.77 ALDH1A1 (0.40) ADORA2BALDH1A1LMNAHTTMAPT
SCHEMBL13206028 0.76 ALDH1A1 (0.37) ADORA2BALDH1A1LMNAHTTMAPT
SCHEMBL5035308 0.76 MAPT (0.38) ADORA2BALDH1A1LMNAHTTMAPT
SCHEMBL14409871 0.75 ALDH1A1 (0.41) ADORA2BALDH1A1LMNAHTTMAPT
SCHEMBL5133078 0.75 ALDH1A1 (0.36) ADORA2BALDH1A1LMNAHTTMAPT
SCHEMBL5132704 0.75 ALDH1A1 (0.43) ADORA2BALDH1A1LMNAHTTMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3055313-B1 CYCLIC THIENOURACIL CARBOXAMIDE AND ITS USE Bayer Pharma AG (DE) 2017-11-22 EP disclosed
EP-3055313-A1 CYCLIC THIENOURACIL-CARBOXAMIDES AND USE THEREOF Bayer Pharma Aktiengesellschaft (DE) 2016-08-17 EP disclosed
WO-2015052065-A1 CYCLIC THIENOURACIL-CARBOXAMIDES AND USE THEREOF BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2015-04-16 WO disclosed