SCHEMBL25977022

SCHEMBL25977022

CCOC(=O)[C@@]12CC=Cc3nc(-c4nn(Cc5ccccc5F)c5ncc(F)cc45)nc(c31)NC2=O

nearest known ligand 0.60

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ PDE5A O76074 18/20 0.60
▸ GUCY1A1 Q02108 2/20 0.55
▸ GUCY1B1 Q02153 2/20 0.55

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
SCHEMBL25977024 1.00 PDE5A (0.60) PDE5AGUCY1A1GUCY1B1
SCHEMBL25975060 1.00 PDE5A (0.60) PDE5AGUCY1A1GUCY1B1
SCHEMBL25975212 0.91 PDE5A (0.64) PDE5AGUCY1A1GUCY1B1
SCHEMBL25975210 0.91 PDE5A (0.64) PDE5AGUCY1A1GUCY1B1
SCHEMBL25976957 0.85 PDE5A (0.59) PDE5AGUCY1A1GUCY1B1
SCHEMBL25976404 0.85 PDE5A (0.59) PDE5AGUCY1A1GUCY1B1
SCHEMBL25976952 0.85 PDE5A (0.59) PDE5AGUCY1A1GUCY1B1
SCHEMBL25977040 0.84 PDE5A (0.58) PDE5AGUCY1A1GUCY1B1
SCHEMBL25975218 0.84 PDE5A (0.58) PDE5AGUCY1A1GUCY1B1
SCHEMBL25975222 0.84 PDE5A (0.58) PDE5AGUCY1A1GUCY1B1

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-20230257398-A1 PYRIMIDINE-BASED TRICYCLIC COMPOUND AND USE THEREOF CHIA TAL TIANQING PHARMACEUTICAL GROUP CO., LTD. (CN) 2023-08-17 — — 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-20230257398-A1 PYRIMIDINE-BASED TRICYCLIC COMPOUND AND USE THEREOF TYMP, TYMS, DPYD PDE5A 1421/4885GUCY1A1 2940/4885GUCY1B1 2239/4885

“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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