SCHEMBL17013473

SCHEMBL17013473

CSc1ncc(C(=O)NCc2ncccn2)c(NCc2ccc(CO)c(Cl)c2)n1

nearest known ligand 0.55

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ PDE5A O76074 11/20 0.52
▸ HTT P42858 1/20 0.46
▸ LMNA P02545 1/20 0.46
▸ MAPT P10636 1/20 0.46

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
SCHEMBL17013478 0.91 THRB (0.56) PDE5AHTTLMNAMAPT
SCHEMBL16848087 0.87 PDE5A (0.51) PDE5ALMNAMAPT
SCHEMBL16816327 0.87 PDE5A (0.68) PDE5A
SCHEMBL17013489 0.86 PDE5A (0.55) PDE5AHTTMAPT
SCHEMBL16116558 0.85 PDE5A (0.54) PDE5ALMNAMAPT
SCHEMBL17013471 0.85 HTT (0.50) HTTLMNAMAPT
SCHEMBL17013475 0.84 PDE5A (0.51) PDE5A
SCHEMBL16816453 0.83 PDE5A (0.68) PDE5A
SCHEMBL17013474 0.81 ALDH1A1 (0.56) PDE5AHTTLMNAMAPT
SCHEMBL17013495 0.80 PDE5A (0.43) PDE5ALMNAMAPT

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-9359371-B2 Bicyclic substituted pyrimidine compounds Xuanzhu Pharma Co., Ltd. (CN) 2016-06-07 — — US disclosed
US-20150232474-A1 Bicyclic Substituted Pyrimidine Compounds Xuanzhu Biopharmaceutical Co., Ltd. (CN) 2015-08-20 — — 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-20150232474-A1 Bicyclic Substituted Pyrimidine Compounds DPYD, UMPS, TYMP PDE5A 81/4885HTT 2667/4885LMNA 3806/4885

“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.

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