SCHEMBL8663025

SCHEMBL8663025

CC(C)CC(=O)C1NC(=O)NC1=O

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.42
SLC25A5 P05141 1/20 0.39
TSHR P16473 2/20 0.38
ADORA2B P29275 3/20 0.36
LMNA P02545 1/20 0.36
RGS12 O14924 1/20 0.34
GAA P10253 2/20 0.33
MMP2 P08253 1/20 0.33
ADAM17 P78536 1/20 0.33
ADAMTS5 Q9UNA0 1/20 0.33
ALDH1A1 P00352 3/20 0.33
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
TDP1 Q9NUW8 1/20 0.32
CASP1 P29466 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
SCHEMBL8835717 0.79 HSD17B10 (0.46) HSD17B10TSHRADORA2BLMNARGS12
SCHEMBL11308612 0.76 TSHR (0.38) HSD17B10TSHRLMNARGS12GAA
SCHEMBL7934703 0.75 HSD17B10 (0.41) HSD17B10TSHRLMNARGS12GAA
SCHEMBL11628675 0.71 TSHR (0.46) HSD17B10TSHRLMNARGS12GAA
SCHEMBL3501182 0.71 TSHR (0.44) HSD17B10TSHRLMNARGS12GAA
SCHEMBL8154208 0.70 ALDH1A1 (0.40) HSD17B10TSHRLMNARGS12GAA
SCHEMBL2064738 0.69 TSHR (0.42) HSD17B10TSHRLMNARGS12GAA
SCHEMBL29067975 0.68 TSHR (0.43) HSD17B10TSHRLMNAGAAMMP2
SCHEMBL29598045 0.68 TSHR (0.43) HSD17B10TSHRLMNAGAAMMP2
SCHEMBL1012052 0.68 TSHR (0.43) HSD17B10TSHRLMNAGAAMMP2

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-0735143-B1 Process for preparing D-amino acids TANABE SEIYAKU CO (JP) 1998-11-18 EP disclosed
US-5783427-A DEGRADATION OF LEVOROTATORY STRUCTURE BY TREATMENT WITH MICROORGANISMS SELECTED FROM PROTEUS, PROVIDENCIA, AND YARROWVIA TANABE SEIYAKU CO., LTD. (JP) 1998-07-21 US disclosed
EP-0735143-A1 Process for preparing D-amino acids TANABE SEIYAKU CO., LTD. (JP) 1996-10-02 EP disclosed