SCHEMBL8299077

SCHEMBL8299077

Cc1nc2c(sc(=S)n2C)c(=O)[nH]1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 7/20 0.66
HTT P42858 2/20 0.66
ALDH1A1 P00352 6/20 0.48
MAPT P10636 3/20 0.48
HSD17B10 Q99714 2/20 0.48
GAA P10253 1/20 0.48
ALOX15 P16050 1/20 0.48
PKM P14618 1/20 0.46
RXFP1 Q9HBX9 1/20 0.46
USP2 O75604 1/20 0.46
SMN1; SMN2 Q16637 4/20 0.43
CDC7 O00311 2/20 0.39
DBF4 Q9UBU7 2/20 0.39
TSHR P16473 1/20 0.39
CCNE1 P24864 1/20 0.37
CDK2 P24941 1/20 0.37
ROCK1 Q13464 1/20 0.37
MAPK1 P28482 1/20 0.37
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35

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
SCHEMBL9377000 0.80 HPGD (0.50) HPGDHTTALDH1A1MAPTHSD17B10
SCHEMBL5406879 0.66 HPGD (0.56) HPGDHTTALDH1A1MAPTSMN1; SMN2
SCHEMBL6425971 0.63 RPS6KA3 (0.45) HPGDHTTALDH1A1MAPTHSD17B10
SCHEMBL7093373 0.62 CYP2C9 (0.50) HPGDALDH1A1HSD17B10GAAALOX15
SCHEMBL515533 0.62 CYP3A4 (0.62) HPGDALDH1A1MAPTHSD17B10ALOX15
SCHEMBL13322482 0.62 MAPK1 (0.42) HPGDHTTALDH1A1MAPTSMN1; SMN2
SCHEMBL10083069 0.61 MAPK1 (0.53) HPGDHTTALDH1A1CDC7DBF4
SCHEMBL387339 0.61 ALDH1A1 (0.54) HTTALDH1A1MAPTHSD17B10GAA
SCHEMBL1369682 0.60 SMN1; SMN2 (0.62) HPGDHTTALDH1A1MAPTGAA
SCHEMBL6708585 0.60 CDK4 (0.52) ALDH1A1MAPK1

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
US-20070037785-A1 Novel dipeptidyl peptidase IV inhibitors used for functionally influencing different cells and treating immunological, infammatory, neuronal, and other diseases KEYNEUROTEK PHARMACEUTICALS AG (DE) 2007-02-15 US disclosed
US-20070037785-A1 Novel dipeptidyl peptidase IV inhibitors used for functionally influencing different cells and treating immunological, infammatory, neuronal, and other diseases KEYNEUROTEK PHARMACEUTICALS AG (DE) 2007-02-15 US disclosed
WO-2005037779-A2 NOVEL DIPEPTIDYL PEPTIDASE IV INHIBITORS USED FOR FUNCTIONALLY INFLUENCING DIFFERENT CELLS AND TREATING IMMUNOLOGICAL, INFLAMMATORY, NEURONAL, AND OTHER DISEASES IMTM GMBH (DE) 2005-04-28 WO disclosed
EP-0327284-B1 Triazolo(1,5-c)pyrimido(1,4) azines as bronchodilators RIKER LABORATORIES INC (US) 1994-08-17 EP disclosed
US-5166343-A Chemical intermediates for bronchodilators RIKER LABORATORIES, INC. (US) 1992-11-24 US disclosed
US-5089493-A Triazolo[1,5-C]pyrimido[1,4]azines as bronchodilators RIKER LABORATORIES, INC. (US) 1992-02-18 US disclosed
US-4981850-A Triazolo[1,5-c]pyrimido[1,4]azines as bronchodilators RIKER LABORATORIES, INC. (US) 1991-01-01 US disclosed
EP-0327284-A2 Triazolo(1,5-c)pyrimido(1,4) azines as bronchodilators RIKER LABORATORIES, INC. (US) 1989-08-09 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 (1 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-20070037785-A1 Novel dipeptidyl peptidase IV inhibitors used for functionally influencing different cells and treating immunological, infammatory, neuronal, and other diseases DNPEP, PREP, DPP4 HPGD 1244/4885HTT 1551/4885ALDH1A1 1472/4885

“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.