SCHEMBL8565045

SCHEMBL8565045

CCOC(=O)c1cc(NC(C)=O)cnc1C(=O)OCC

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.45
LMNA P02545 2/20 0.45
ALDH1A1 P00352 2/20 0.45
GALR2 O43603 1/20 0.45
MITF O75030 1/20 0.45
POLB P06746 1/20 0.45
HSP90AA1 P07900 1/20 0.45
HPGD P15428 1/20 0.45
XBP1 P17861 1/20 0.45
CCR6 P51684 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
TDP1 Q9NUW8 3/20 0.44
MMP13 P45452 1/20 0.43
ALOX15 P16050 2/20 0.43
RORC P51449 1/20 0.43
MAPT P10636 1/20 0.42
KMT2A Q03164 3/20 0.42
MEN1 O00255 1/20 0.42
CYP1A2 P05177 1/20 0.42

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
SCHEMBL8321765 0.85 PDK1 (0.45) ALDH1A1POLBALOX15MAPTKMT2A
SCHEMBL29859779 0.79 TSHR (0.47) TSHRLMNAALDH1A1HSP90AA1HPGD
SCHEMBL6559030 0.79 TSHR (0.47) TSHRLMNAALDH1A1HSP90AA1HPGD
SCHEMBL29897883 0.77 TSHR (0.46) TSHRLMNAALDH1A1HSP90AA1HPGD
SCHEMBL6559833 0.77 TSHR (0.46) TSHRLMNAALDH1A1HSP90AA1HPGD
SCHEMBL10465834 0.77 CYP2C19 (0.53) TSHRSMN1; SMN2LMNAALDH1A1NPSR1
SCHEMBL9793651 0.77 TDP1 (0.64) SMN1; SMN2LMNAALDH1A1TDP1MMP13
SCHEMBL10668140 0.76 OPRK1 (0.49) TSHRSMN1; SMN2ALDH1A1POLBNPSR1
SCHEMBL8318161 0.76 ALDH1A1 (0.50) TSHRSMN1; SMN2LMNAALDH1A1HSP90AA1
SCHEMBL18405255 0.75 BRD4 (0.48) TSHRSMN1; SMN2LMNAALDH1A1GALR2

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
EP-0663399-B1 Pyridine-2,3-dicarboxylic imides, process for their preparation and their use to control the growth of unwanted plants BASF AG (DE) 1998-06-10 EP claimed