SCHEMBL23810443

SCHEMBL23810443

COc1ncc(F)c2c(S(=O)(=O)N3CCCN(C(=O)OC(C)(C)C)C[C@H]3C)cccc12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ROCK2 O75116 8/20 0.51
▸ ROCK1 Q13464 8/20 0.51
▸ MMP13 P45452 2/20 0.43
▸ MMP1 P03956 1/20 0.43
▸ MMP9 P14780 1/20 0.43
▸ CNR1 P21554 1/20 0.41
▸ PLK4 O00444 1/20 0.40
▸ NQO2 P16083 1/20 0.40
▸ MARK3 P27448 1/20 0.40
▸ MAP2K3 P46734 1/20 0.40
▸ CDK9 P50750 1/20 0.40
▸ PRKAG1 P54619 1/20 0.40
▸ PRKCD Q05655 1/20 0.40
▸ PRKAA1 Q13131 1/20 0.40
▸ PKN1 Q16512 1/20 0.40
▸ PKN2 Q16513 1/20 0.40
▸ MARK2 Q7KZI7 1/20 0.40
▸ MAP4K3 Q8IVH8 1/20 0.40
▸ AURKB Q96GD4 1/20 0.40
▸ PRKD2 Q9BZL6 1/20 0.40

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
SCHEMBL23795336 1.00 ROCK2 (0.51) ROCK2ROCK1MMP13MMP1MMP9
SCHEMBL23810379 0.90 ROCK2 (0.52) ROCK2ROCK1MMP13MMP1MMP9
SCHEMBL23795408 0.90 ROCK2 (0.52) ROCK2ROCK1MMP13MMP1MMP9
SCHEMBL24178331 0.89 ROCK2 (0.43) ROCK2ROCK1MMP13MMP1MMP9
SCHEMBL23795410 0.89 ROCK2 (0.43) ROCK2ROCK1MMP13MMP1MMP9
SCHEMBL23795420 0.84 MMP13 (0.45) ROCK2ROCK1MMP13MMP1MMP9
SCHEMBL23810437 0.84 MMP13 (0.45) ROCK2ROCK1MMP13MMP1MMP9
SCHEMBL31541 0.83 ROCK2 (0.70) ROCK2ROCK1MMP13MMP1MMP9
SCHEMBL14990561 0.83 ROCK2 (0.70) ROCK2ROCK1MMP13MMP1MMP9
SCHEMBL4898445 0.81 ROCK2 (0.68) ROCK2ROCK1MMP13MMP1MMP9

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
US-20220002265-A1 RHO KINASE INHIBITOR, METHOD FOR PREPARING SAME AND USES THEREOF BEIJING INCREASE INNOVATIVE DRUG CO., LTD (CN) 2022-01-06 — — US disclosed
EP-3878846-A1 RHO KINASE INHIBITOR, METHOD FOR PREPARING SAME AND USES THEREOF Beijing Increase Innovative Drug Co., Ltd. (CN) 2021-09-15 — — 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-20220002265-A1 RHO KINASE INHIBITOR, METHOD FOR PREPARING SAME AND USES THEREOF ROCK1, RHOA, ROCK2 ROCK2 3/4885ROCK1 1/4885MMP13 269/4885

“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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