SCHEMBL3212819

SCHEMBL3212819

CNc1cccc2sc(NC(=O)OC(C)(C)C)nc12

nearest known ligand 0.54

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.54
LCK P06239 12/20 0.49
DYRK1A Q13627 2/20 0.47
RET P07949 1/20 0.42
FLT1 P17948 1/20 0.42
KDR P35968 1/20 0.42
MAPK14 Q16539 1/20 0.42

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
SCHEMBL1284899 0.85 MAPT (0.76) MAPTLCK
SCHEMBL23183609 0.85 DYRK1A (0.67) MAPTLCKDYRK1ARETFLT1
SCHEMBL3283781 0.84 MAPT (0.55) MAPTLCKDYRK1A
SCHEMBL1284898 0.84 MAPT (0.55) MAPTLCKDYRK1A
SCHEMBL23974266 0.84 LCK (0.56) MAPTLCKDYRK1A
SCHEMBL29454481 0.84 LCK (0.56) MAPTLCKDYRK1A
SCHEMBL3053547 0.82 DYRK1A (0.70) MAPTLCKDYRK1A
SCHEMBL21839507 0.82 MAPT (0.54) MAPTLCKDYRK1A
SCHEMBL16743933 0.82 MEN1 (0.62) MAPTLCKDYRK1A
SCHEMBL31733133 0.81 MAPT (0.53) MAPTLCKDYRK1A

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-1957516-B1 ALFA-HELIX MIMETICS AND METHOD RELATING TO THE TREATMENT OF CANCER STEM CELLS CHOONGWAE PHARMA CORP (KR) 2016-03-09 EP disclosed
US-8293743-B2 Substituted imidazo[1,2-A]pyrazine derivatives as alpha-helix mimetics and method relating to the treatment of cancer stem cells CHOONGWAE PHARMA CORPORATION (KR) 2012-10-23 US disclosed
US-20100069333-A1 ALPHA-HELIX MIMETICS AND METHOD RELATING TO THE TREATMENT OF CANCER STEM CELLS CHOONGWAE PHARMA CORPORATION (KR) 2010-03-18 US disclosed
US-20090176742-A1 METHODS RELATING TO THE TREATMENT OF FIBROTIC DISORDERS UNIVERSITY OF WASHINGTON (US) 2009-07-09 US disclosed
US-20080242669-A1 METHODS RELATING TO THE TREATMENT OF FIBROTIC DISORDERS UNIVERSITY OF WASHINGTON (US) 2008-10-02 US disclosed
EP-1957516-A2 ALFA-HELIX MIMETICS AND METHOD RELATING TO THE TREATMENT OF CANCER STEM CELLS Choongwae Pharma Corporation (KR) 2008-08-20 EP disclosed
US-20080009500-A1 Alpha-helix mimetics and methods relating to the treatment of fibrotic disorders INSTITUTE FOR CHEMICAL GENOMICS 2008-01-10 US disclosed
US-20070129353-A1 Alpha-helix mimetics and method relating to the treatment of cancer stem cells INSTITUTE FOR CHEMICAL GENOMICS 2007-06-07 US disclosed
WO-2007056513-A1 α-HELIX MIMETICS AND METHODS RELATING TO THE TREATMENT OF FIBROTIC DISORDERS INSTITUTE FOR CHEMICAL GENOMICS (US) 2007-05-18 WO disclosed
WO-2007056593-A2 α-HELIX MIMETICS AND METHOD RELATING TO THE TREATMENT OF CANCER STEM CELLS CHOONGWAE PHARMA CORPORATION (KR) 2007-05-18 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 (5 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-20080009500-A1 Alpha-helix mimetics and methods relating to the treatment of fibrotic disorders COL1A1, COL2A1, PLOD3 MAPT 2446/4885LCK 4331/4885DYRK1A 4772/4885
US-20080242669-A1 METHODS RELATING TO THE TREATMENT OF FIBROTIC DISORDERS NR3C1, RXFP3, NR2E3 MAPT 4304/4885LCK 3163/4885DYRK1A 2518/4885
US-20070129353-A1 Alpha-helix mimetics and method relating to the treatment of cancer stem cells MCL1, HNF4A, THPO MAPT 2031/4885LCK 4738/4885DYRK1A 4476/4885
US-20090176742-A1 METHODS RELATING TO THE TREATMENT OF FIBROTIC DISORDERS RXFP3, NR3C1, NR2E3 MAPT 4249/4885LCK 3139/4885DYRK1A 2144/4885
US-20100069333-A1 ALPHA-HELIX MIMETICS AND METHOD RELATING TO THE TREATMENT OF CANCER STEM CELLS MCL1, HNF4A, THPO MAPT 2031/4885LCK 4721/4885DYRK1A 4512/4885

“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.