SCHEMBL15211526

SCHEMBL15211526

COC(=O)C(CO)c1coc2cc(OCc3ccc(OC)cc3)ccc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TERT O14746 1/20 0.47
NPC1 O15118 3/20 0.47
RAB9A P51151 3/20 0.47
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
CASP3 P42574 1/20 0.47
SENP8 Q96LD8 1/20 0.47
SENP7 Q9BQF6 1/20 0.47
SENP6 Q9GZR1 1/20 0.47
AR P10275 1/20 0.43
MAPT P10636 5/20 0.43
POLB P06746 2/20 0.43
PPARD Q03181 1/20 0.43
PPARA Q07869 1/20 0.43
KDM4E B2RXH2 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
SMPD1 P17405 1/20 0.42
ALDH1A1 P00352 2/20 0.41
HTT P42858 1/20 0.41
PTGES O14684 1/20 0.41

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
SCHEMBL17431383 0.81 NPC1 (0.49) TERTNPC1RAB9AMEN1KMT2A
SCHEMBL1390926 0.80 PPARD (0.46) NPC1RAB9AMEN1KMT2ACASP3
SCHEMBL15211199 0.74 NPC1 (0.51) TERTNPC1RAB9AMEN1KMT2A
SCHEMBL19178491 0.74 PPARD (0.72) NPC1RAB9AMEN1KMT2ACASP3
SCHEMBL1390473 0.73 PPARA (0.50) NPC1RAB9AMEN1KMT2AMAPT
SCHEMBL1390694 0.72 MTNR1A (0.47) NPC1PPARDPPARA
SCHEMBL1390645 0.72 MTNR1A (0.46) NPC1RAB9AMEN1KMT2ACASP3
SCHEMBL5447303 0.71 ALDH1A1 (0.50) NPC1RAB9AMEN1KMT2AMAPT
SCHEMBL4143937 0.71 AKR1C3 (0.52) NPC1RAB9AMEN1KMT2AMAPT
SCHEMBL1390614 0.71 ACACB (0.47) NPC1RAB9AMEN1KMT2AMAPT

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