SCHEMBL712706

SCHEMBL712706

COc1ccc(OCc2ccccc2)cc1C(=O)O

nearest known ligand 0.60

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CTSV O60911 4/20 0.60
CTSL P07711 4/20 0.60
MAOB P27338 2/20 0.57
FOLH1 Q04609 1/20 0.56
NR4A2 P43354 2/20 0.54
KDM4E B2RXH2 1/20 0.54
ALDH1A1 P00352 1/20 0.54
HPGD P15428 1/20 0.54
NR4A1 P22736 1/20 0.54
NR4A3 Q92570 1/20 0.54
MCL1 Q07820 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
MRGPRX4 Q96LA9 1/20 0.53
PARP15 Q460N3 1/20 0.53
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53

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
SCHEMBL27934345 0.91 MAOB (0.57) CTSVCTSLMAOBALDH1A1HPGD
SCHEMBL7282913 0.90 MAOB (0.68) MAOBL3MBTL1
SCHEMBL344833 0.89 FOLH1 (0.68) CTSVCTSLMAOBFOLH1NR4A2
SCHEMBL9366548 0.89 MAOB (0.52) CTSVCTSLMAOBALDH1A1HPGD
SCHEMBL29717104 0.89 MAOB (0.55) CTSVCTSLMAOBALDH1A1HPGD
SCHEMBL711327 0.89 MAOB (0.55) CTSVCTSLMAOBALDH1A1HPGD
SCHEMBL15709261 0.89 PARP15 (0.60) MAOBALDH1A1L3MBTL1PARP15
SCHEMBL1647498 0.88 FOLH1 (0.63) CTSVCTSLMAOBFOLH1KDM4E
SCHEMBL1448026 0.88 MAOB (0.61) CTSVCTSLMAOBNR4A2KDM4E
SCHEMBL10468446 0.87 FOLH1 (0.58) CTSVCTSLMAOBFOLH1NR4A2

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 22 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9278940-B2 Cyclic amines as bromodomain inhibitors ZENITH EPIGENETICS CORP. (CA) 2016-03-08 US disclosed
US-9278940-B2 Cyclic amines as bromodomain inhibitors ZENITH EPIGENETICS CORP. (CA) 2016-03-08 US disclosed
US-20150344442-A1 CYCLIC AMINES AS BROMODOMAIN INHIBITORS ZENITH EPIGENETICS CORP. (CA) 2015-12-03 US disclosed
US-20150344442-A1 CYCLIC AMINES AS BROMODOMAIN INHIBITORS ZENITH EPIGENETICS CORP. (CA) 2015-12-03 US disclosed
US-9073878-B2 Cyclic amines as bromodomain inhibitors ZENITH EPIGENETICS CORP. (CA) 2015-07-07 US disclosed
US-9073878-B2 Cyclic amines as bromodomain inhibitors ZENITH EPIGENETICS CORP. (CA) 2015-07-07 US disclosed
US-20140142102-A1 CYCLIC AMINES AS BROMODOMAIN INHIBITORS RVX THERAPEUTICS INC. (CA) 2014-05-22 US disclosed
US-20140142102-A1 CYCLIC AMINES AS BROMODOMAIN INHIBITORS RVX THERAPEUTICS INC. (CA) 2014-05-22 US disclosed
US-8470816-B2 Nitrogen-containing heterocyclic compound and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2013-06-25 US disclosed
EP-1940837-B1 IMIDAZOPYRIDINE COMPOUNDS TAKEDA PHARMACEUTICAL (JP) 2012-11-07 EP disclosed
US-8124617-B2 Imidazopyridine compounds TAKEDA SAN DIEGO, INC. (US) 2012-02-28 US disclosed
US-8124617-B2 Imidazopyridine compounds TAKEDA SAN DIEGO, INC. (US) 2012-02-28 US disclosed
US-20100069431-A1 IMIDAZOPYRIDINE COMPOUNDS TAKEDA SAN DIEGO, INC. 2010-03-18 US disclosed
US-20100069431-A1 IMIDAZOPYRIDINE COMPOUNDS TAKEDA SAN DIEGO, INC. 2010-03-18 US disclosed
US-20100069431-A1 IMIDAZOPYRIDINE COMPOUNDS TAKEDA SAN DIEGO, INC. 2010-03-18 US disclosed
US-20090156572-A1 Nitrogen-containing heterocyclic compound and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED 2009-06-18 US disclosed
WO-2009072643-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-06-11 WO disclosed
EP-1940837-A2 IMIDAZOPYRIDINE COMPOUNDS Takeda Pharmaceutical Company Limited (JP) 2008-07-09 EP disclosed
WO-2007028135-A2 IMIDAZOPYRIDINE COMPOUNDS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-03-08 WO disclosed
WO-2007028135-A2 IMIDAZOPYRIDINE COMPOUNDS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-03-08 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100069431-A1 IMIDAZOPYRIDINE COMPOUNDS GCK, GCKR, KHK CTSV 2625/4885CTSL 1247/4885MAOB 1046/4885
US-20140142102-A1 CYCLIC AMINES AS BROMODOMAIN INHIBITORS BRDT, BRD4, BRD3 CTSV 4383/4885CTSL 4586/4885MAOB 770/4885
US-20150344442-A1 CYCLIC AMINES AS BROMODOMAIN INHIBITORS BRDT, BRD4, BRD3 CTSV 4383/4885CTSL 4586/4885MAOB 770/4885
US-20090156572-A1 Nitrogen-containing heterocyclic compound and use thereof NTSR2, NTSR1, HNMT CTSV 1562/4885CTSL 1613/4885MAOB 320/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.