SCHEMBL1615005

SCHEMBL1615005

Cc1nn2c(=O)cc(C(C)(C)C)[nH]c2c1-c1cccs1

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.38
LMNA P02545 1/20 0.38
PARP1 P09874 4/20 0.37
ADORA3 P0DMS8 2/20 0.37
CA12 O43570 2/20 0.36
CA9 Q16790 2/20 0.36
GAA P10253 1/20 0.34
ADORA2A P29274 1/20 0.34
TYMP P19971 1/20 0.34
PLAT P00750 4/20 0.34
KDM4E B2RXH2 1/20 0.33
HPGD P15428 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HSD17B10 Q99714 1/20 0.33
PDE10A Q9Y233 1/20 0.33

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
SCHEMBL1613643 0.89 KDM4E (0.41) ALDH1A1LMNAPARP1ADORA3GAA
SCHEMBL1613652 0.88 PARP1 (0.40) ALDH1A1LMNAPARP1ADORA3TYMP
SCHEMBL1279413 0.85 SMN1; SMN2 (0.36) ALDH1A1LMNAPARP1ADORA3CA12
SCHEMBL1613744 0.81 PARP1 (0.37) ALDH1A1PARP1ADORA3TYMPPLAT
SCHEMBL1614785 0.80 MEN1 (0.46) ALDH1A1LMNAGAAPLATKDM4E
SCHEMBL1613668 0.80 ADORA3 (0.39) ALDH1A1LMNAPARP1ADORA3GAA
SCHEMBL1279326 0.80 MEN1 (0.38) ALDH1A1LMNAPARP1ADORA3ADORA2A
SCHEMBL1614734 0.77 MAPK14 (0.40) ALDH1A1LMNAPARP1ADORA3ADORA2A
SCHEMBL1614981 0.77 KCNQ3 (0.37) ALDH1A1PARP1ADORA3GAATYMP
SCHEMBL1279265 0.76 SMN1; SMN2 (0.41) ALDH1A1LMNAPARP1ADORA3GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8796285-B2 Pyrazolo [1,5-a]-pyrimidones derivatives and pharmaceutical compositions and uses thereof HEBEI MEDICAL UNIVERSITY (CN) 2014-08-05 US disclosed
US-20120088775-A1 Pyrazolo-[1,5-a]-Pyrimidones Derivatives and Pharmaceutical Compositions and Uses Thereof PEKING UNIVERSITY (CN) 2012-04-12 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 (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-20120088775-A1 Pyrazolo-[1,5-a]-Pyrimidones Derivatives and Pharmaceutical Compositions and Uses Thereof KCNJ2, KCNQ5, KCNJ11 ALDH1A1 159/4885LMNA 2076/4885PARP1 640/4885

“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.