SCHEMBL14907754

SCHEMBL14907754

O=C(O)CSc1nnc(-c2ccc(-c3ccccc3)cc2)[nH]1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRK6 P43250 3/20 0.56
KDM4E B2RXH2 1/20 0.52
PRKAG1 P54619 1/20 0.49
PRKAA2 P54646 1/20 0.49
PRKAB1 Q9Y478 1/20 0.49
KMT2A Q03164 3/20 0.49
ALDH1A1 P00352 2/20 0.46
NPSR1 Q6W5P4 1/20 0.46
FFAR1 O14842 1/20 0.43
RAB9A P51151 2/20 0.43
THRB P10828 1/20 0.43
MMP12 P39900 1/20 0.42
MMP13 P45452 1/20 0.42
TYMP P19971 2/20 0.42
TDP1 Q9NUW8 1/20 0.42
NPC1 O15118 1/20 0.41
MEN1 O00255 2/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C9 P11712 1/20 0.41

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
SCHEMBL23527345 0.87 PTGES (0.53) KDM4EKMT2AALDH1A1NPSR1RAB9A
SCHEMBL19425608 0.87 TYMP (0.57) GRK6KDM4EPRKAG1PRKAA2PRKAB1
SCHEMBL11887741 0.87 TYMP (0.57) GRK6KDM4EKMT2AALDH1A1NPSR1
SCHEMBL14907760 0.86 GRK6 (0.60) GRK6KDM4EPRKAG1PRKAA2PRKAB1
SCHEMBL14907849 0.85 GRK6 (0.57) GRK6KDM4EPRKAG1PRKAA2PRKAB1
SCHEMBL16171071 0.84 GRK6 (0.46) GRK6KDM4EPRKAG1PRKAA2PRKAB1
SCHEMBL23527338 0.84 PTGES (0.59) KDM4EKMT2AALDH1A1RAB9ATDP1
SCHEMBL14907787 0.83 GRK6 (0.65) GRK6KDM4EPRKAG1PRKAA2PRKAB1
SCHEMBL21763932 0.83 TDP1 (0.46) GRK6KMT2AALDH1A1TDP1MEN1
SCHEMBL14907846 0.83 MAPT (0.48) GRK6KDM4EKMT2AALDH1A1FFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3134390-B1 SMALL MOLECULE INHIBITORS OF G PROTEIN COUPLED RECEPTOR 6 KINASE POLYPEPTIDES MAYO FOUND MEDICAL EDUCATION & RES (US) 2020-02-26 EP disclosed
US-10252984-B2 Inhibiting G protein coupled receptor 6 kinase polypeptides MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH (US) 2019-04-09 US disclosed
US-20170050939-A1 SMALL MOLECULE INHIBITORS OF G PROTEIN COUPLED RECEPTOR 6 KINASE POLYPEPTIDES MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH (US) 2017-02-23 US disclosed
US-20170050939-A1 SMALL MOLECULE INHIBITORS OF G PROTEIN COUPLED RECEPTOR 6 KINASE POLYPEPTIDES MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH (US) 2017-02-23 US disclosed
WO-2015164415-A1 SMALL MOLECULE INHIBITORS OF G PROTEIN COUPLED RECEPTOR 6 KINASE POLYPEPTIDES MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH (US) 2015-10-29 WO disclosed
US-20140309185-A1 Inhibiting G Protein Coupled Receptor 6 Kinase Polypeptides MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH 2014-10-16 US disclosed
US-20140309185-A1 Inhibiting G Protein Coupled Receptor 6 Kinase Polypeptides MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH 2014-10-16 US disclosed
WO-2013063458-A2 INHIBITING G PROTEIN COUPLED RECEPTOR 6 KINASE POLYPEPTIDES MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH (US) 2013-05-02 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-20170050939-A1 SMALL MOLECULE INHIBITORS OF G PROTEIN COUPLED RECEPTOR 6 KINASE POLYPEPTIDES GRK6, GRK2, GRK3 GRK6 1/4885KDM4E 4539/4885PRKAG1 320/4885
US-20140309185-A1 Inhibiting G Protein Coupled Receptor 6 Kinase Polypeptides GRK6, GRK2, GRK3 GRK6 1/4885KDM4E 4504/4885PRKAG1 224/4885
US-10252984-B2 Inhibiting G protein coupled receptor 6 kinase polypeptides GRK6, GRK2, GRK3 GRK6 1/4885KDM4E 4504/4885PRKAG1 224/4885

“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.