SCHEMBL16631677

SCHEMBL16631677

CCc1cn(Cn2cc(C)c(=O)[nH]c2=O)nn1

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.44
HPGD P15428 1/20 0.43
TK1 P04183 2/20 0.41
TYMP P19971 3/20 0.39
ALDH1A1 P00352 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
TK2 O00142 1/20 0.38
EP300 Q09472 1/20 0.36

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
SCHEMBL16631675 0.84 MAPK1 (0.48) MAPK1HPGDTK1TYMPALDH1A1
SCHEMBL18080418 0.83 EP300 (0.33) TYMPEP300
SCHEMBL16631662 0.82 HPGD (0.56) MAPK1HPGDTK1TK2
SCHEMBL16631398 0.81 MAPK1 (0.51) MAPK1HPGDTK1EP300
SCHEMBL18081935 0.80 MAPK1 (0.43) MAPK1HPGDTK1TYMPALDH1A1
SCHEMBL16631660 0.76 HPGD (0.52) MAPK1HPGDTK1TK2
SCHEMBL16631672 0.74 MAPK1 (0.47) MAPK1HPGDTK1TYMPALDH1A1
SCHEMBL18081921 0.73 HPGD (0.69) MAPK1HPGDTK1
SCHEMBL10065935 0.73 CYP19A1 (0.42)
SCHEMBL16631314 0.72 PYGM (0.37)

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-20160264614-A1 POLYNUCLEOTIDE MOLECULES AND USES THEREOF MODERNA THERAPEUTICS, INC. (US) 2016-09-15 US disclosed
WO-2015051173-A2 POLYNUCLEOTIDE MOLECULES AND USES THEREOF MODERNA THERAPEUTICS, INC (US) 2015-04-09 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 (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-20160264614-A1 POLYNUCLEOTIDE MOLECULES AND USES THEREOF POLRMT, POLN, NSUN3 MAPK1 4185/4885HPGD 3931/4885TK1 269/4885

“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.