SCHEMBL23762076

SCHEMBL23762076

Cc1ccc(S(=O)(=O)n2cc(-c3cc(NC(=O)c4ccccc4)ncn3)c3c(Oc4ccc5c(c4)CN(C(=O)OC(C)(C)C)CC5)ccnc32)cc1

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ GCK P35557 3/20 0.36
▸ HTR6 P50406 1/20 0.36
▸ CDK9 P50750 3/20 0.35
▸ MAP3K5 Q99683 5/20 0.34
▸ NR1H2 P55055 1/20 0.34
▸ RAB9A P51151 2/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ ADORA3 P0DMS8 1/20 0.33
▸ RAF1 P04049 1/20 0.33
▸ BRAF P15056 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
SCHEMBL21593133 0.90 GCK (0.35) GCKMAP3K5LMNAMAPTKMT2A
SCHEMBL21593100 0.90 ACHE (0.38) GCKHTR6NR1H2MEN1LMNA
SCHEMBL29836487 0.90 ACHE (0.38) GCKHTR6NR1H2MEN1LMNA
SCHEMBL21593188 0.90 HTR6 (0.35) GCKHTR6MAP3K5NR1H2
SCHEMBL21593137 0.90 HTR6 (0.35) GCKHTR6MAP3K5NR1H2
SCHEMBL21593181 0.89 HTR6 (0.35) GCKHTR6NR1H2MEN1LMNA
SCHEMBL21593186 0.89 HTR6 (0.36) GCKHTR6NR1H2LMNA
SCHEMBL21593182 0.85 HCRTR2 (0.35) GCKHTR6MAP3K5NR1H2MEN1
SCHEMBL21593138 0.85 HCRTR2 (0.34) GCKHTR6CDK9MAP3K5NR1H2
SCHEMBL21593132 0.83 ACHE (0.40) GCKHTR6CDK9MAP3K5NR1H2

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 GCK 3395/4885HTR6 2835/4885CDK9 438/4885

“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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