SCHEMBL23751124

SCHEMBL23751124

C[Si](C)(C)CCOCn1ccc2c(Oc3ccc4c(c3)CN(C(=O)O)CC4)ccnc21

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ HRH3 Q9Y5N1 4/20 0.36
▸ F10 P00742 9/20 0.34
▸ PORCN Q9H237 1/20 0.34
▸ PLG P00747 2/20 0.33
▸ PRSS1 P07477 1/20 0.33
▸ PRSS2 P07478 1/20 0.33
▸ PRSS3 P35030 1/20 0.33
▸ ABCB1 P08183 4/20 0.33
▸ KMT2A Q03164 1/20 0.33

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
SCHEMBL23762242 0.90 NR1H2 (0.43) HRH3F10PORCNABCB1
SCHEMBL29836508 0.90 NR1H2 (0.43) HRH3F10PORCNABCB1
SCHEMBL22772343 0.85 HRH3 (0.35) HRH3F10PORCNPLGPRSS1
SCHEMBL22772329 0.85 HRH3 (0.35) HRH3F10PORCNPLGPRSS1
SCHEMBL22772328 0.83 S1PR1 (0.37) HRH3ABCB1KMT2A
SCHEMBL23751241 0.83 F10 (0.36) HRH3F10PORCNPLGPRSS1
SCHEMBL23751145 0.83 HRH3 (0.34) HRH3F10PORCNPLGPRSS1
SCHEMBL23751254 0.83 F10 (0.37) HRH3F10PORCNPLGPRSS1
SCHEMBL23751117 0.82 HRH3 (0.35) HRH3F10PORCNPLGPRSS1
SCHEMBL23751164 0.82 HRH3 (0.33) HRH3F10PORCNPLGPRSS1

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-20210253568-A1 AZAINDOLE DERIVATIVES AS RHO-KINASE INHIBITORS CHIESI FARMACEUTICI S.P.A. (IT) 2021-08-19 — — 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-20210253568-A1 AZAINDOLE DERIVATIVES AS RHO-KINASE INHIBITORS ROCK1, ROCK2, RHOA HRH3 550/4885F10 3027/4885PORCN 4747/4885

“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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