SCHEMBL1677549

SCHEMBL1677549

Nc1nc(-c2ccco2)c(C(=O)c2ccco2)s1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.56
MEN1 O00255 1/20 0.56
ALDH1A1 P00352 1/20 0.56
POLB P06746 1/20 0.56
MAPT P10636 1/20 0.56
PKM P14618 1/20 0.56
ALOX15 P16050 1/20 0.56
CASP1 P29466 1/20 0.56
BLM P54132 1/20 0.56
CASP7 P55210 1/20 0.56
KMT2A Q03164 1/20 0.56
HSD17B10 Q99714 1/20 0.56
HSP90AA1 P07900 1/20 0.51
ADORA2A P29274 14/20 0.50
ADORA1 P30542 10/20 0.50
FBP1 P09467 1/20 0.48
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
ADORA3 P0DMS8 1/20 0.44
SCN3A Q9NY46 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
SCHEMBL1256076 0.85 ADORA2A (0.69) L3MBTL1MEN1ALDH1A1POLBMAPT
SCHEMBL1256201 0.83 ADORA2A (0.56) L3MBTL1MEN1ALDH1A1POLBMAPT
SCHEMBL1255867 0.82 ADORA2A (0.52) L3MBTL1MEN1ALDH1A1POLBMAPT
SCHEMBL1256514 0.82 MEN1 (0.51) L3MBTL1MEN1ALDH1A1POLBMAPT
SCHEMBL1255464 0.81 MEN1 (0.50) L3MBTL1MEN1ALDH1A1POLBMAPT
SCHEMBL1256138 0.81 ADORA2A (0.51) L3MBTL1MEN1ALDH1A1POLBMAPT
SCHEMBL1256118 0.81 ADORA2A (0.54) L3MBTL1MEN1ALDH1A1POLBMAPT
SCHEMBL1677366 0.81 RORB (0.61) L3MBTL1MEN1ALDH1A1POLBMAPT
SCHEMBL1255518 0.80 L3MBTL1 (0.60) L3MBTL1MEN1ALDH1A1POLBMAPT
SCHEMBL1256786 0.80 ADORA2A (0.53) L3MBTL1MEN1ALDH1A1POLBMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1921077-B1 AGENT FOR TREATING AND/OR PREVENTING SLEEP DISORDER KYOWA HAKKO KIRIN CO LTD (JP) 2017-07-26 EP disclosed
EP-3002283-A1 THIAZOLE DERIVATIVES Kyowa Hakko Kirin Co., Ltd. (JP) 2016-04-06 EP disclosed
US-8889718-B2 Thiazole derivatives KYOWA HAKKO KIRIN CO., LTD. (JP) 2014-11-18 US disclosed
US-20130267509-A1 THIAZOLE DERIVATIVES KYOWA HAKKO KIRIN CO., LTD. (JP) 2013-10-10 US disclosed
US-7928098-B2 Therapeutic and/or preventive agents for a sleep disorder KYOWA HAKKO KIRIN CO., LTD. (JP) 2011-04-19 US disclosed
US-20100152162-A1 THERAPEUTIC AND/OR PREVENTIVE AGENTS FOR A SLEEP DISORDER KYOWA HAKKO KIRIN CO., LTD. (JP) 2010-06-17 US disclosed
US-7718808-B2 Thiazole derivatives KYOWA HAKKO KIRIN CO., LTD. (JP) 2010-05-18 US disclosed
EP-1921077-A1 AGENT FOR TREATING AND/OR PREVENTING SLEEP DISORDER KYOWA HAKKO KOGYO CO., LTD. (JP) 2008-05-14 EP disclosed
US-20070105919-A1 adenosine A2A receptor antagonists; N-[4-(2-Furyl)-5-(4-pyridyl)thiazol-2-yl]pyridine-4-carboxamide; treatment of Parkinson's disease, Alzheimer's disease, progressive supranuclear palsy, AIDS encephalopathy, nerve system disorders KYOWA HAKKO KOGYO CO., LTD. (JP) 2007-05-10 US disclosed
EP-1700856-A1 THIAZOLE DERIVATIVE KYOWA HAKKO KOGYO CO., LTD. (JP) 2006-09-13 EP 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-20130267509-A1 THIAZOLE DERIVATIVES THRA, CHD8, CYP2C8 L3MBTL1 436/4885MEN1 1954/4885ALDH1A1 1344/4885
US-20070105919-A1 adenosine A2A receptor antagonists; N-[4-(2-Furyl)-5-(4-pyridyl)thiazol-2-yl]pyridine-4-carboxamide; treatment of Parkinson's disease, Alzheimer's disease, progressive supranuclear palsy, AIDS encephalopathy, nerve system disorders ADORA2A, ADORA3, ADORA1 L3MBTL1 2473/4885MEN1 3769/4885ALDH1A1 2843/4885
US-20100152162-A1 THERAPEUTIC AND/OR PREVENTIVE AGENTS FOR A SLEEP DISORDER HCRTR1, MTNR1A, HCRTR2 L3MBTL1 1732/4885MEN1 4098/4885ALDH1A1 638/4885

“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.