SCHEMBL15211345

SCHEMBL15211345

COC(=O)CC(=O)CSc1cccc(OC)c1C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 4/20 0.44
POLB P06746 2/20 0.44
KDM4E B2RXH2 5/20 0.42
ALDH1A1 P00352 5/20 0.42
HPGD P15428 3/20 0.42
GAA P10253 2/20 0.42
MAPT P10636 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
LMNA P02545 1/20 0.42
MTNR1A P48039 1/20 0.42
MTNR1B P49286 1/20 0.42
KMT2A Q03164 2/20 0.39
PKM P14618 1/20 0.39
CYP3A4 P08684 1/20 0.38
CYP2C19 P33261 1/20 0.38
CA12 O43570 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA7 P43166 1/20 0.37
CA9 Q16790 1/20 0.37

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
SCHEMBL5481572 0.91 ALDH1A1 (0.46) HSD17B10POLBKDM4EALDH1A1HPGD
SCHEMBL72974 0.79 HSD17B10 (0.50) HSD17B10POLBKDM4EALDH1A1HPGD
SCHEMBL3338630 0.75 HSD17B10 (0.46) HSD17B10POLBKDM4EALDH1A1HPGD
SCHEMBL20819196 0.75 POLB (0.51) HSD17B10POLBKDM4EALDH1A1HPGD
SCHEMBL20121222 0.73 HPGD (0.40) HSD17B10KDM4EALDH1A1HPGDMAPT
SCHEMBL15211190 0.72 HSD17B10 (0.40) HSD17B10POLBKDM4EALDH1A1HPGD
SCHEMBL14459702 0.71 PKM (0.44) HSD17B10POLBKDM4EALDH1A1HPGD
SCHEMBL7963942 0.71 HSD17B10 (0.61) HSD17B10POLBKDM4EALDH1A1HPGD
SCHEMBL7977530 0.71 HSD17B10 (0.54) HSD17B10POLBKDM4EALDH1A1HPGD
SCHEMBL17431296 0.71 HSD17B10 (0.43) HSD17B10POLBKDM4EALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2838891-B1 AROMATIC RING COMPOUND AS GHRELIN O-ACYLTRANSFERASE INHIBITOR TAKEDA PHARMACEUTICALS CO (JP) 2017-08-02 EP disclosed
US-9238639-B2 Aromatic ring compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2016-01-19 US disclosed
EP-2838891-A1 AROMATIC RING COMPOUND Takeda Pharmaceutical Company Limited (JP) 2015-02-25 EP disclosed
WO-2013125732-A1 AROMATIC RING COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2013-08-29 WO disclosed