SCHEMBL16631915

SCHEMBL16631915

Cn1cc(Cn2cc(Cc3ccccc3)nn2)c(=O)[nH]c1=O

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KCNMA1 Q12791 2/20 0.55
HRH4 Q9H3N8 4/20 0.45
HRH3 Q9Y5N1 3/20 0.45
CYP19A1 P11511 7/20 0.44
MPO P05164 1/20 0.40
AMY1A P0DUB6 1/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
TK2 O00142 1/20 0.39
TK1 P04183 1/20 0.39
CHRNE Q04844 1/20 0.39
HPGD P15428 1/20 0.39

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
SCHEMBL16631692 0.91 CYP19A1 (0.50) KCNMA1HRH4CYP19A1MPOAMY1A
SCHEMBL18080399 0.89 KCNMA1 (0.54) KCNMA1HRH4HRH3CYP19A1MPO
SCHEMBL18081754 0.82 CHRNE (0.35) KCNMA1CYP19A1AMY1ACHRNE
SCHEMBL18080377 0.81 CYP19A1 (0.48) KCNMA1HRH4CYP19A1MPOAMY1A
SCHEMBL16631913 0.81 CYP19A1 (0.52) CYP19A1NPC1RAB9A
SCHEMBL16631388 0.78 KCNMA1 (0.47) KCNMA1HRH4HRH3TK2TK1
SCHEMBL16631731 0.78 KCNMA1 (0.54) KCNMA1HRH4HRH3CYP19A1MPO
SCHEMBL18081774 0.77 AMY1A (0.33) MPOAMY1A
SCHEMBL16631909 0.77 MAPK1 (0.34) CHRNEHPGD
SCHEMBL16631910 0.76 MEN1 (0.31) HPGD

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 KCNMA1 4287/4885HRH4 4824/4885HRH3 4639/4885

“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.