SCHEMBL8033430

SCHEMBL8033430

CCCCCC1(CC)C(=O)NC(=S)NC1=O

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.51
MMP2 P08253 6/20 0.47
MMP9 P14780 6/20 0.47
MMP8 P22894 4/20 0.45
MMP13 P45452 4/20 0.45
ALDH1A1 P00352 3/20 0.43
KDM4E B2RXH2 2/20 0.43
PKM P14618 2/20 0.43
MEN1 O00255 1/20 0.43
MAPT P10636 1/20 0.43
HPGD P15428 1/20 0.43
KMT2A Q03164 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.40
ELANE P08246 1/20 0.37
MMP3 P08254 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36

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
SCHEMBL145409 0.86 KMT2A (0.47) LMNAMMP2MMP9MMP8MMP13
SCHEMBL918796 0.84 LMNA (0.64) LMNAMMP2MMP9MMP8MMP13
SCHEMBL4382583 0.82 MMP9 (0.63) LMNAMMP2MMP9MMP8MMP13
SCHEMBL4379822 0.82 MMP9 (0.63) LMNAMMP2MMP9MMP8MMP13
SCHEMBL712742 0.82 MMP9 (0.63) LMNAMMP2MMP9MMP8MMP13
SCHEMBL4390355 0.82 MMP9 (0.63) LMNAMMP2MMP9MMP8MMP13
SCHEMBL10580926 0.81 CPT1A (0.51) LMNAMMP2MMP9MMP8MMP13
SCHEMBL10583965 0.81 CPT1A (0.51) LMNAMMP2MMP9MMP8MMP13
SCHEMBL10582806 0.81 CPT1A (0.51) LMNAMMP2MMP9MMP8MMP13
SCHEMBL10582675 0.81 CPT1A (0.51) LMNAMMP2MMP9MMP8MMP13

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-2000072848-A1 COMPOSITION COMPRISING (±)-5-ETHYLDIHYDRO-5-(1-METHYLBUTYL)-2-THIOXO 4,6(1H,5H)-PYRIMIDINEDIONE DISSOLVED IN 2,5-DI-O-METHYL-1,4:3,6-DIANHYDRO-D-GLUCITOL PATEL DINESH SHANTILAL (IN) 2000-12-07 WO claimed