SCHEMBL23927683

SCHEMBL23927683

CC(C)[Si](OCc1ccc(C(CN2C(=O)c3ccccc3C2=O)C(=O)N2C(=O)OC[C@H]2Cc2ccccc2)cc1)(C(C)C)C(C)C

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 1/20 0.38
IDH1 O75874 11/20 0.37
MAPK1 P28482 1/20 0.36
IL6ST P40189 1/20 0.34
FAAH O00519 1/20 0.34
NAMPT P43490 2/20 0.33
NAAA Q02083 1/20 0.33
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
RAB9A P51151 1/20 0.32
MEN1 O00255 1/20 0.32
ALDH1A1 P00352 1/20 0.32
GAA P10253 1/20 0.32
KMT2A Q03164 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32

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
SCHEMBL23927686 1.00 PPARA (0.38) PPARAIDH1MAPK1IL6STFAAH
SCHEMBL23927680 1.00 PPARA (0.38) PPARAIDH1MAPK1IL6STFAAH
SCHEMBL23927694 0.92 FAAH (0.38) PPARAIDH1MAPK1IL6STFAAH
SCHEMBL30744169 0.92 FAAH (0.38) PPARAIDH1MAPK1IL6STFAAH
SCHEMBL23927690 0.92 FAAH (0.38) PPARAIDH1MAPK1IL6STFAAH
SCHEMBL23927693 0.92 FAAH (0.38) PPARAIDH1MAPK1IL6STFAAH
SCHEMBL23522285 0.86 PPARA (0.39) PPARAIDH1MAPK1IL6STNAAA
SCHEMBL30744181 0.86 PPARA (0.39) PPARAIDH1MAPK1IL6STNAAA
SCHEMBL23501240 0.80 IL6ST (0.41) PPARAIDH1IL6STFAAHNAAA
SCHEMBL23927598 0.80 IL6ST (0.41) PPARAIDH1IL6STFAAHNAAA

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-20220332726-A1 NITROXIDE DERIVATIVE OF ROCK KINASE INHIBITOR VIVAVISION (SHANGHAI) LTD (CN) 2022-10-20 US disclosed
EP-3901156-A1 NITROOXYDERIVATIVE OF ROCK KINASE INHIBITOR Vivavision (Shanghai) Ltd (CN) 2021-10-27 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-20220332726-A1 NITROXIDE DERIVATIVE OF ROCK KINASE INHIBITOR ROCK1, NOS1, ROCK2 PPARA 4561/4885IDH1 234/4885MAPK1 47/4885

“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.