SCHEMBL13029019

SCHEMBL13029019

C=C1OB(c2cncc(OCC)c2)OC1(C)C

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 2/20 0.33
CYP11B2 P19099 2/20 0.33
CHRNB2 P17787 2/20 0.33
CHRNA4 P43681 2/20 0.33
CHRNB4 P30926 1/20 0.33
CHRNA3 P32297 1/20 0.33
CHRNA7 P36544 1/20 0.33
CCNC P24863 1/20 0.30
CDK8 P49336 1/20 0.30

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
SCHEMBL13034614 0.86 CYP11B1 (0.35) CYP11B1CYP11B2
SCHEMBL13030134 0.86 CHRNB2 (0.35) CHRNB2CHRNA4
SCHEMBL13100337 0.85 ROCK2 (0.31) CYP11B1CYP11B2
SCHEMBL13029000 0.82 CHRNB2 (0.32) CYP11B1CYP11B2CHRNB2CHRNA4
SCHEMBL2066788 0.80 AAK1 (0.39) CYP11B1CYP11B2CHRNB2CHRNA4CHRNB4
SCHEMBL13030784 0.78 PIK3C3 (0.31)
SCHEMBL13100346 0.76
SCHEMBL13457775 0.76 HCAR2 (0.31)
SCHEMBL805363 0.73
SCHEMBL13100275 0.73 RAF1 (0.30)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100311714-A1 1H-IMIDAZO[4,5-c]QUINOLINONE COMPOUNDS NOVARTIS AG (CH) 2010-12-09 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-20100311714-A1 1H-IMIDAZO[4,5-c]QUINOLINONE COMPOUNDS PRKCA, ABL1, MYLK2 CYP11B1 977/4885CYP11B2 1164/4885CHRNB2 4351/4885

“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.