SCHEMBL22966950

SCHEMBL22966950

CC(C)NC(=O)C(C)Oc1ccc(B2OC(C)(C)C(C)(C)O2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA1 P00915 5/20 0.46
▸ CA2 P00918 5/20 0.46
▸ CA9 Q16790 5/20 0.46
▸ AAK1 Q2M2I8 1/20 0.44
▸ ALDH1A1 P00352 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ HTT P42858 1/20 0.40
▸ CA12 O43570 1/20 0.40
▸ CA3 P07451 1/20 0.40
▸ CA4 P22748 1/20 0.40
▸ CA6 P23280 1/20 0.40
▸ CA5A P35218 1/20 0.40
▸ CA7 P43166 1/20 0.40
▸ CA14 Q9ULX7 1/20 0.40
▸ CA5B Q9Y2D0 1/20 0.40
▸ TSHR P16473 1/20 0.39
▸ LPL P06858 4/20 0.39
▸ LIPG Q9Y5X9 4/20 0.39
▸ HIF1A Q16665 2/20 0.38
▸ P4HB P07237 1/20 0.38

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
SCHEMBL18343416 0.86 OGG1 (0.41) AAK1ALDH1A1KDM4EHTTTSHR
SCHEMBL31188697 0.83 CYP1A2 (0.51) CA1CA2CA9AAK1ALDH1A1
SCHEMBL14168092 0.82 CA1 (0.52) CA1CA2CA9AAK1CA12
SCHEMBL15739649 0.79 CA1 (0.53) CA1CA2CA9AAK1ALDH1A1
SCHEMBL21217992 0.77 HIF1A (0.56) CA1CA2CA9AAK1ALDH1A1
SCHEMBL21217717 0.76 AAK1 (0.47) CA1CA2CA9AAK1CA12
SCHEMBL10041245 0.76 CA1 (0.54) CA1CA2CA9AAK1CA12
SCHEMBL5850578 0.76 CA1 (0.54) CA1CA2CA9AAK1CA12
SCHEMBL21217719 0.75 AAK1 (0.49) CA1CA2CA9AAK1ALDH1A1
SCHEMBL16611798 0.74 MTNR1A (0.48) CA1CA2CA9AAK1CA12

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240216386-A1 MODULATORS OF RHO-ASSOCIATED PROTEIN KINASE REDX PHARMA LIMITED (GB) 2024-07-04 — — US disclosed
US-20230021916-A1 MODULATORS OF RHO-ASSOCIATED PROTEIN KINASE REDX PHARMA LIMITED (GB) 2023-01-26 — — US disclosed
EP-4026834-A1 HETEROCYCLYLAMINO-SUBSTITUTED TRIAZOLES AS MODULATORS OF RHO-ASSOCIATED PROTEIN KINASE Redx Pharma Plc (GB) 2022-07-13 — — EP disclosed
US-20210038606-A1 Modulators of Rho-associated Protein Kinase REDX PHARMA LIMITED (GB) 2021-02-11 — — 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 (3 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-20240216386-A1 MODULATORS OF RHO-ASSOCIATED PROTEIN KINASE ROCK2, ROCK1, RHOA CA1 4161/4885CA2 856/4885CA9 4169/4885
US-20210038606-A1 Modulators of Rho-associated Protein Kinase ROCK2, ROCK1, RHOA CA1 4041/4885CA2 762/4885CA9 4114/4885
US-20230021916-A1 MODULATORS OF RHO-ASSOCIATED PROTEIN KINASE ROCK2, ROCK1, RHOA CA1 4161/4885CA2 856/4885CA9 4169/4885

“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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