SCHEMBL8784359

SCHEMBL8784359

Cc1ccc2oc(=O)c(C(=O)O)c(-c3ccccc3)c2c1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.64
MAPT P10636 5/20 0.64
ALDH1A1 P00352 4/20 0.64
HPGD P15428 4/20 0.64
MEN1 O00255 3/20 0.64
KMT2A Q03164 3/20 0.64
HTT P42858 2/20 0.64
SMN1; SMN2 Q16637 2/20 0.64
NPC1 O15118 1/20 0.64
RAB9A P51151 1/20 0.64
L3MBTL1 Q9Y468 1/20 0.56
HSD17B10 Q99714 3/20 0.52
CYP3A4 P08684 3/20 0.52
TP53 P04637 2/20 0.52
GFER P55789 1/20 0.50
MAOB P27338 3/20 0.49
POLB P06746 1/20 0.48
CA12 O43570 1/20 0.47
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47

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
SCHEMBL9307463 0.85 KDM4E (0.53) KDM4EMAPTALDH1A1HPGDMEN1
SCHEMBL8786172 0.85 ALDH1A1 (0.57) KDM4EMAPTALDH1A1HPGDMEN1
SCHEMBL7115026 0.84 MAPT (0.59) KDM4EMAPTALDH1A1HPGDMEN1
SCHEMBL8785838 0.83 CA1 (0.56) KDM4EALDH1A1KMT2AL3MBTL1CA1
SCHEMBL9306855 0.83 KDM4E (0.51) KDM4EMAPTALDH1A1HPGDMEN1
SCHEMBL8201626 0.81 L3MBTL1 (0.60) KDM4EMAPTALDH1A1HPGDMEN1
SCHEMBL11330155 0.81 KDM4E (0.56) KDM4EMAPTALDH1A1HPGDMEN1
SCHEMBL8784891 0.80 PIM1 (0.59) KDM4EMAPTALDH1A1HPGDMEN1
SCHEMBL11480049 0.80 MAOB (0.71) KDM4EMAPTALDH1A1HPGDMEN1
SCHEMBL14307644 0.80 ERAP1 (0.61) KDM4EMAPTALDH1A1HPGDMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0585913-B1 Condensed heterocyclic compounds, their production and use TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1997-12-29 EP disclosed
US-5700810-A Condensed heterocyclic compounds, their production and use TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1997-12-23 US disclosed
US-5482967-A LOWERING CHOLESTEROL TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1996-01-09 US disclosed
CN-1090274-A Condensed heterocyclic compounds and its preparation method and application TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1994-08-03 CN disclosed
EP-0585913-A2 Condensed heterocyclic compounds, their production and use TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1994-03-09 EP disclosed