SCHEMBL5596519

SCHEMBL5596519

[CH2]CCOCCSC(C)=O

nearest known ligand 0.40

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 1/20 0.40
POLB P06746 1/20 0.39
BLM P54132 1/20 0.39
ATM Q13315 1/20 0.39

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
SCHEMBL1777653 0.89 CYP2C19 (0.48) CYP2C19POLBBLMATM
SCHEMBL5596697 0.88 CYP2C19 (0.38) CYP2C19POLBBLMATM
SCHEMBL17883360 0.86 CYP2C19 (0.46) CYP2C19POLBBLMATM
SCHEMBL19999151 0.86 CYP2C19 (0.46) CYP2C19POLBBLMATM
SCHEMBL5596429 0.84
SCHEMBL15890591 0.80 CYP2C19 (0.41) CYP2C19POLBBLMATM
SCHEMBL15890590 0.80 TSHR (0.46) CYP2C19POLBBLMATM
SCHEMBL5596714 0.79 TDP1 (0.31) CYP2C19
SCHEMBL888204 0.78 MEN1 (0.48) CYP2C19POLBBLMATM
SCHEMBL13301154 0.78 MEN1 (0.48) CYP2C19POLBBLMATM

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
EP-1829876-A1 NITROGENEOUS TRICYCLIC COMPOUND Asahi Kasei Pharma Corporation (JP) 2007-09-05 EP disclosed
US-20060247266-A1 Nitrogen-containing tricyclic compounds ASAHI KASEI PHARMA CORPORATION (JP) 2006-11-02 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-20060247266-A1 Nitrogen-containing tricyclic compounds MYO1B, CHRM1, MYL12A CYP2C19 4112/4885POLB 2903/4885BLM 2457/4885

“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.