SCHEMBL6218964

SCHEMBL6218964

CCOC(=O)c1sc2nc(-c3ccccc3)cc(-c3ccccc3)c2c1N

nearest known ligand 0.83

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 12/20 0.83
KDM4E B2RXH2 10/20 0.83
ALDH1A1 P00352 6/20 0.83
GAA P10253 3/20 0.83
MAPK1 P28482 2/20 0.83
L3MBTL1 Q9Y468 2/20 0.83
HPGD P15428 6/20 0.69
SMN1; SMN2 Q16637 2/20 0.69
NPC1 O15118 2/20 0.69
RAB9A P51151 2/20 0.69
TDP1 Q9NUW8 2/20 0.65
LIMK1 P53667 2/20 0.65
RCE1 Q9Y256 1/20 0.63
LMNA P02545 1/20 0.63
MEN1 O00255 3/20 0.62
KMT2A Q03164 3/20 0.62
IKBKB O14920 1/20 0.60
GLA P06280 1/20 0.59
CASP1 P29466 1/20 0.59
CASP7 P55210 1/20 0.59

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
SCHEMBL1322128 0.91 MEN1 (0.73) MAPTKDM4EALDH1A1GAAMAPK1
SCHEMBL6216362 0.91 MAPT (0.70) MAPTKDM4EALDH1A1GAAMAPK1
SCHEMBL6218571 0.89 MAPT (0.73) MAPTKDM4EALDH1A1GAAMAPK1
SCHEMBL6214310 0.89 KDM4E (0.67) MAPTKDM4EALDH1A1GAAMAPK1
SCHEMBL6215605 0.89 ALDH1A1 (0.73) MAPTKDM4EALDH1A1GAAMAPK1
SCHEMBL6217262 0.83 MAPT (0.86) MAPTKDM4EALDH1A1GAAMAPK1
SCHEMBL4194506 0.82 LIMK1 (0.82) MAPTKDM4EALDH1A1GAAMAPK1
SCHEMBL7496360 0.82 MAPT (0.84) MAPTKDM4EALDH1A1GAAMAPK1
SCHEMBL7505903 0.82 MAPT (0.62) MAPTKDM4EALDH1A1GAAMAPK1
SCHEMBL21973659 0.81 HPGD (0.62) MAPTKDM4EALDH1A1GAAMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200140453-A1 COMPOSITIONS AND METHODS OF MODULATING 15-PGDH ACTIVITY NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2020-05-07 US disclosed
US-10301320-B2 Compositions and methods of modulating 15-PGDH activity UNIVERSITY OF KENTUCKY RESEARCH FOUNDATION (US) 2019-05-28 US disclosed
US-9790233-B2 Compositions and methods of modulating 15-PGDH activity CASE WESTERN RESERVE UNIVERSITY (US) 2017-10-17 US disclosed
US-9790233-B2 Compositions and methods of modulating 15-PGDH activity CASE WESTERN RESERVE UNIVERSITY (US) 2017-10-17 US disclosed
US-20170165241-A1 COMPOSITIONS AND METHODS OF MODULATING 15-PGDH ACTIVITY BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM 2017-06-15 US disclosed
US-20170165241-A1 COMPOSITIONS AND METHODS OF MODULATING 15-PGDH ACTIVITY BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM 2017-06-15 US disclosed
US-20150072998-A1 COMPOSITIONS AND METHODS OF MODULATING 15-PGDH ACTIVITY BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM 2015-03-12 US disclosed
US-20150072998-A1 COMPOSITIONS AND METHODS OF MODULATING 15-PGDH ACTIVITY BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM 2015-03-12 US disclosed
EP-1171443-B1 BICYCLIC HETEROAROMATIC COMPOUNDS USEFUL AS LH AGONISTS AKZO NOBEL NV (NL) 2005-07-13 EP disclosed
US-6841553-B2 Bicyclic heteroaromatic compounds useful as LH agonists AKZO NOBEL N.V. (NL) 2005-01-11 US disclosed
US-20030212081-A1 Bicyclic heteroaromatic compounds useful as LH agonists MERCK SHARP & DOHME B.V. (NL) 2003-11-13 US disclosed
US-6569863-B1 Luteinizing hormone (LH) agonists for controlling fertility AKZO NOBEL NV (NL) 2003-05-27 US 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-20030212081-A1 Bicyclic heteroaromatic compounds useful as LH agonists LHCGR, GNRHR, FSHR MAPT 4619/4885KDM4E 2123/4885ALDH1A1 757/4885
US-20170165241-A1 COMPOSITIONS AND METHODS OF MODULATING 15-PGDH ACTIVITY PTGS1, HPGD, PTGIS MAPT 4311/4885KDM4E 3434/4885ALDH1A1 415/4885
US-20200140453-A1 COMPOSITIONS AND METHODS OF MODULATING 15-PGDH ACTIVITY PTGS1, HPGD, PTGIS MAPT 4311/4885KDM4E 3434/4885ALDH1A1 415/4885
US-20150072998-A1 COMPOSITIONS AND METHODS OF MODULATING 15-PGDH ACTIVITY PTGS1, HPGD, PTGIS MAPT 4311/4885KDM4E 3434/4885ALDH1A1 415/4885
US-10301320-B2 Compositions and methods of modulating 15-PGDH activity PTGS1, HPGD, PTGIS MAPT 4311/4885KDM4E 3434/4885ALDH1A1 415/4885

“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.