SCHEMBL1648702

SCHEMBL1648702

O=c1cc(-c2cc(F)c(Cl)nc2Cl)[nH]c2c(-c3ccc(F)cc3)c(C(F)(F)F)nn12

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ARF6 P62330 9/20 0.49
KCNQ3 O43525 6/20 0.45
KCNQ2 O43526 6/20 0.45
KCNQ1 P51787 1/20 0.45
PLAT P00750 1/20 0.41
PSD A5PKW4 4/20 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
SCHEMBL10062354 0.92 KCNQ3 (0.54) ARF6KCNQ3KCNQ2KCNQ1PLAT
SCHEMBL10062409 0.86 KCNQ3 (0.59) ARF6KCNQ3KCNQ2KCNQ1PLAT
SCHEMBL1614776 0.86 PSD (0.39) ARF6KCNQ3KCNQ2KCNQ1PLAT
SCHEMBL1279352 0.83 ARF6 (0.59) ARF6KCNQ3KCNQ2PLATPSD
SCHEMBL1649492 0.83 KCNQ3 (0.44) ARF6KCNQ3KCNQ2KCNQ1PLAT
SCHEMBL10062355 0.83 KCNQ3 (0.54) ARF6KCNQ3KCNQ2KCNQ1PLAT
SCHEMBL1278555 0.78 KCNQ3 (0.50) ARF6KCNQ3KCNQ2KCNQ1PLAT
SCHEMBL19084538 0.78 ARF6 (0.58) ARF6KCNQ3KCNQ2PLATPSD
SCHEMBL1279264 0.78 ARF6 (0.45) ARF6KCNQ3KCNQ2KCNQ1PLAT
SCHEMBL1614778 0.78 KCNQ3 (0.46) KCNQ3KCNQ2KCNQ1PLAT

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 3 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-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 ARF6 3851/4885KCNQ3 12/4885KCNQ2 9/4885

“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.