SCHEMBL1614841

SCHEMBL1614841

COc1ccc(-c2nc3ccc(Cl)nc3o2)cc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 3/20 0.69
MAOB P27338 3/20 0.59
NPC1 O15118 8/20 0.52
RAB9A P51151 8/20 0.52
SMN1; SMN2 Q16637 4/20 0.52
MAPT P10636 4/20 0.52
ALDH1A1 P00352 3/20 0.52
LMNA P02545 2/20 0.52
KDM4E B2RXH2 2/20 0.52
TP53 P04637 3/20 0.45
HDAC6 Q9UBN7 1/20 0.45
POLB P06746 1/20 0.45
NOTUM Q6P988 1/20 0.44
KMT2A Q03164 1/20 0.44
HPGD P15428 1/20 0.43
NFKB1 P19838 1/20 0.43
NFKB2 Q00653 1/20 0.43
RELA Q04206 1/20 0.43
HSD17B10 Q99714 1/20 0.43
IKBKB O14920 1/20 0.43

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
SCHEMBL14693936 0.83 MAOB (0.54) APPMAOBNPC1RAB9ASMN1; SMN2
SCHEMBL14693807 0.82 MAOB (0.65) APPMAOBNPC1RAB9ASMN1; SMN2
SCHEMBL14693835 0.80 MAOB (0.56) APPMAOBNPC1RAB9ASMN1; SMN2
SCHEMBL14693861 0.80 MAOB (0.57) APPMAOBNPC1RAB9ASMN1; SMN2
SCHEMBL13351692 0.79 MAOB (0.70) APPMAOBNPC1RAB9ASMN1; SMN2
SCHEMBL1615277 0.79 APP (0.66) APPMAOBNPC1RAB9ASMN1; SMN2
SCHEMBL11644349 0.79 MAOB (0.55) APPMAOBNPC1RAB9ASMN1; SMN2
SCHEMBL14486171 0.78 APP (0.44) APPMAOBNPC1RAB9ASMN1; SMN2
SCHEMBL13904223 0.78 MAOB (0.48) APPMAOBNPC1RAB9ATP53
SCHEMBL1614965 0.76 APP (0.61) APPMAOBNPC1RAB9ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2560008-B1 Pharmaceutical compositions for preventing or treating degenerative brain disease and method of screening the same KOREA INST SCI & TECH (KR) 2016-11-30 EP disclosed
EP-2560008-B1 Pharmaceutical compositions for preventing or treating degenerative brain disease and method of screening the same KOREA INST SCI & TECH (KR) 2016-11-30 EP disclosed
US-9469653-B2 Pharmaceutical compositions for preventing or treating degenerative brain disease and method of screening the same KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2016-10-18 US disclosed
US-9469653-B2 Pharmaceutical compositions for preventing or treating degenerative brain disease and method of screening the same KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2016-10-18 US disclosed
EP-2300481-B1 NOVEL SUBSTITUTED AZABENZOXAZOLES MERCK SHARP & DOHME (US) 2015-09-30 EP disclosed
EP-2300481-B1 NOVEL SUBSTITUTED AZABENZOXAZOLES MERCK SHARP & DOHME (US) 2015-09-30 EP disclosed
US-20140142089-A1 PHARMACEUTICAL COMPOSITIONS FOR PREVENTING OR TREATING DEGENERATIVE BRAIN DISEASE AND METHOD OF SCREENING THE SAME KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2014-05-22 US disclosed
US-20140142089-A1 PHARMACEUTICAL COMPOSITIONS FOR PREVENTING OR TREATING DEGENERATIVE BRAIN DISEASE AND METHOD OF SCREENING THE SAME KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2014-05-22 US disclosed
US-8530483-B2 Substituted azabenzoxazoles MERCK SHARP & DOHME CORP. (US) 2013-09-10 US disclosed
US-8530483-B2 Substituted azabenzoxazoles MERCK SHARP & DOHME CORP. (US) 2013-09-10 US disclosed
EP-2560008-A2 Pharmaceutical compositions for preventing or treating degenerative brain disease and method of screening the same Korea Institute of Science and Technology (KR) 2013-02-20 EP disclosed
EP-2560008-A2 Pharmaceutical compositions for preventing or treating degenerative brain disease and method of screening the same Korea Institute of Science and Technology (KR) 2013-02-20 EP disclosed
US-20110212031-A1 NOVEL SUBSTITUTED AZABENZOXAZOLES MERCK SHARP & DOHME CORP. 2011-09-01 US disclosed
US-20110212031-A1 NOVEL SUBSTITUTED AZABENZOXAZOLES MERCK SHARP & DOHME CORP. 2011-09-01 US disclosed
US-20110212031-A1 NOVEL SUBSTITUTED AZABENZOXAZOLES MERCK SHARP & DOHME CORP. 2011-09-01 US disclosed
US-20110085985-A1 NOVEL SUBSTITUTED AZABENZOXAZOLES MERCK SHARP & DOHME LLC 2011-04-14 US disclosed
US-20110085985-A1 NOVEL SUBSTITUTED AZABENZOXAZOLES MERCK SHARP & DOHME LLC 2011-04-14 US disclosed
US-20110085985-A1 NOVEL SUBSTITUTED AZABENZOXAZOLES MERCK SHARP & DOHME LLC 2011-04-14 US disclosed
WO-2010051196-A1 NOVEL SUBSTITUTED AZABENZOXAZOLES MERCK SHARP & DOHME CORP. (US) 2010-05-06 WO disclosed
WO-2009155017-A2 NOVEL SUBSTITUTED AZABENZOXAZOLES MERCK & CO., INC. (US) 2009-12-23 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 (3 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-20140142089-A1 PHARMACEUTICAL COMPOSITIONS FOR PREVENTING OR TREATING DEGENERATIVE BRAIN DISEASE AND METHOD OF SCREENING THE SAME PSEN2, PSEN1, GRN APP 11/4885MAOB 396/4885NPC1 112/4885
US-20110085985-A1 NOVEL SUBSTITUTED AZABENZOXAZOLES APBA1, APP, BACE1 APP 2/4885MAOB 21/4885NPC1 662/4885
US-20110212031-A1 NOVEL SUBSTITUTED AZABENZOXAZOLES MAOB, MAOA, AANAT APP 73/4885MAOB 1/4885NPC1 1904/4885

“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.