SCHEMBL1614895

SCHEMBL1614895

Cc1nn2c(=O)cc(COC(=O)C(F)(F)F)[nH]c2c1N1CCNCC1

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PLAT P00750 14/20 0.38
ITGB3 P05106 1/20 0.34
ITGA2B P08514 1/20 0.34
ALDH1A1 P00352 1/20 0.34
CCR4 P51679 1/20 0.33
HTR2C P28335 2/20 0.32
KHK P50053 1/20 0.31

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
SCHEMBL15926364 0.77 PLAT (0.37) PLATITGB3ITGA2BALDH1A1HTR2C
SCHEMBL1614869 0.77 MAPT (0.38) PLATALDH1A1
SCHEMBL15908924 0.69 ARF6 (0.42) PLATALDH1A1
SCHEMBL15909132 0.69 ARF6 (0.36) PLAT
SCHEMBL1614376 0.67 PLAT (0.58) PLATITGB3ITGA2B
SCHEMBL15909113 0.66 POLB (0.36) ALDH1A1
SCHEMBL15909266 0.65 ARF6 (0.39) PLAT
SCHEMBL1286603 0.65 PLAT (0.61) PLATITGB3ITGA2BALDH1A1
SCHEMBL20625703 0.62 SMN1; SMN2 (0.50) ALDH1A1
SCHEMBL27202626 0.61 MCHR1 (0.37) ALDH1A1HTR2C

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 PLAT 1286/4885ITGB3 1725/4885ITGA2B 2685/4885

“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.