SCHEMBL3064069

SCHEMBL3064069

CCOc1nc(N)cc(C)c1C#N

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPK8 P45983 12/20 0.49
MAPK9 P45984 9/20 0.49
PRKD3 O94806 2/20 0.49
MAPK10 P53779 2/20 0.49
MAP4K4 O95819 1/20 0.49
MAP4K2 Q12851 1/20 0.49
PKN2 Q16513 1/20 0.49
PRKD2 Q9BZL6 1/20 0.49
STK17A Q9UEE5 1/20 0.49
RPS27 P42677 4/20 0.48
RECQL P46063 1/20 0.45
KDM4E B2RXH2 2/20 0.45
SQOR Q9Y6N5 1/20 0.43
ALDH1A1 P00352 3/20 0.43
HPGD P15428 2/20 0.43
HSD17B10 Q99714 1/20 0.43
GAA P10253 1/20 0.42
POLB P06746 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
SCHEMBL1145009 0.85 MAPK8 (0.60) MAPK8MAPK9PRKD3MAPK10MAP4K4
SCHEMBL9820174 0.83 ALDH1A1 (0.57) RECQLKDM4EALDH1A1HPGDHSD17B10
SCHEMBL17163957 0.81 RECQL (0.67) MAPK8MAPK9RECQLKDM4ESQOR
SCHEMBL20606873 0.77 MAPK8 (0.59) MAPK8MAPK9PRKD3MAPK10MAP4K4
SCHEMBL553686 0.73 KDM4E (0.55) RECQLKDM4EALDH1A1HPGDHSD17B10
SCHEMBL30411552 0.73 KDM4E (0.71) RECQLKDM4EALDH1A1HPGDHSD17B10
SCHEMBL1140140 0.73 KDM4E (0.71) RECQLKDM4EALDH1A1HPGDHSD17B10
SCHEMBL30370553 0.73 KDM4E (0.55) RECQLKDM4EALDH1A1HPGDHSD17B10
SCHEMBL1145693 0.73 MAPK8 (0.61) MAPK8MAPK9PRKD3MAPK10MAP4K4
SCHEMBL1145762 0.72 MAPK8 (0.63) MAPK8MAPK9PRKD3MAPK10MAP4K4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8541406-B2 Thiadiazole derivatives for the treatment of neurodegenerative diseases NV REMYND (BE) 2013-09-24 US disclosed
US-20100261707-A9 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES NV REMYND (BE) 2010-10-14 US disclosed
US-20090233911-A2 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES NV REMYND (BE) 2009-09-17 US disclosed
US-20090054410-A1 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES NV REMYND (BE) 2009-02-26 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 (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-20090233911-A2 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES SNCA, HTT, PARK7 MAPK8 3418/4885MAPK9 3203/4885PRKD3 30/4885
US-20100261707-A9 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES SNCA, HTT, PARK7 MAPK8 3418/4885MAPK9 3203/4885PRKD3 30/4885
US-20090054410-A1 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES SNCA, HTT, PARK7 MAPK8 3418/4885MAPK9 3203/4885PRKD3 30/4885

“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.