SCHEMBL5415346

SCHEMBL5415346

c1cc2c(cnn2C2CCCCO2)c(N2CCOCC2)c1OC1CCCCO1

nearest known ligand 0.40

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ ATR Q13535 19/20 0.40
▸ RXRA P19793 1/20 0.37
▸ RXRB P28702 1/20 0.37
▸ RXRG P48443 1/20 0.37

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
SCHEMBL5418094 0.82 RXRA (0.42) ATRRXRARXRBRXRG
SCHEMBL5413171 0.82 RXRA (0.40) ATRRXRARXRBRXRG
SCHEMBL5413130 0.79 RXRA (0.38) ATRRXRARXRBRXRG
SCHEMBL5409247 0.79 RXRA (0.38) ATRRXRARXRBRXRG
SCHEMBL5425273 0.79 RXRA (0.40) ATRRXRARXRBRXRG
SCHEMBL5417592 0.79 RXRA (0.40) ATRRXRARXRBRXRG
SCHEMBL5412256 0.79 RXRA (0.38) ATRRXRARXRBRXRG
SCHEMBL5407927 0.79 RXRA (0.38) ATRRXRARXRBRXRG
SCHEMBL5419556 0.77 RXRA (0.39) ATRRXRARXRBRXRG
SCHEMBL5419719 0.76 RXRA (0.38) ATRRXRARXRBRXRG

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-7199147-B2 Rho kinase inhibitors DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2007-04-03 — — US disclosed
US-20040138286-A1 Rho kinase inhibitors DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2004-07-15 — — US disclosed
EP-1403255-A1 Rho KINASE INHIBITORS SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2004-03-31 — — EP 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-20040138286-A1 Rho kinase inhibitors ROCK1, ROCK2, ARHGDIA ATR 2422/4885RXRA 1096/4885RXRB 1324/4885

“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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