SCHEMBL7980756

SCHEMBL7980756

CCCC(=O)Oc1cnc2scnn12

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.48
PKM P14618 1/20 0.48
HPGD P15428 1/20 0.48
HSD17B10 Q99714 1/20 0.48
ALDH1A1 P00352 2/20 0.44
ALOX15 P16050 1/20 0.34
BCL9 O00512 1/20 0.33
CTNNB1 P35222 1/20 0.33
RAB9A P51151 1/20 0.31
KMT2A Q03164 1/20 0.31
CA2 P00918 2/20 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
SCHEMBL7980755 0.69 MAPT (0.36) KDM4EPKMHPGDHSD17B10ALDH1A1
SCHEMBL27660661 0.66 ALOX15 (0.39) KDM4EHSD17B10ALDH1A1ALOX15BCL9
SCHEMBL7982607 0.65 ADORA2A (0.43) KDM4EHPGDHSD17B10ALDH1A1RAB9A
SCHEMBL6624655 0.64 L3MBTL1 (0.41) PKMALDH1A1ALOX15BCL9CTNNB1
SCHEMBL27750732 0.63 ALDH1A1 (0.38) KDM4EHSD17B10ALDH1A1ALOX15BCL9
SCHEMBL28369356 0.62 ALDH1A1 (0.36) KDM4EHSD17B10ALDH1A1ALOX15BCL9
SCHEMBL9737854 0.61 ALDH1A1 (0.43) KDM4EHSD17B10ALDH1A1ALOX15BCL9
SCHEMBL27518195 0.61 SMN1; SMN2 (0.48) HPGDHSD17B10ALDH1A1ALOX15BCL9
SCHEMBL7983188 0.60 ALDH1A1 (0.48) KDM4EPKMHPGDHSD17B10ALDH1A1
SCHEMBL2254046 0.60

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
US-6174877-B1 EXCELLANT BACTERICIDES, ORAL ABSORBABILITY AND STABILITY; IMPROVE THE STABILITY TO RENAL DEHYDROPEPTIDASE I (DHP-I); 2-(2-(N-HETEROCYCLIC-ETHYLTHIO-) DERIVATIVES TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2001-01-16 US disclosed
EP-0876370-A1 CARBAPENEM COMPOUNDS, THEIR PRODUCTION AND USE Takeda Chemical Industries, Ltd. (JP) 1998-11-11 EP disclosed
WO-1997025325-A1 CARBAPENEM COMPOUNDS, THEIR PRODUCTION AND USE TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1997-07-17 WO disclosed