SCHEMBL21593136

SCHEMBL21593136

Cc1ccc(S(=O)(=O)n2cc(-c3ccnc(NCc4ccccc4)c3)c3c(Oc4ccc(CNC(=O)OC(C)(C)C)cc4F)ccnc32)cc1

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TRIM24 O15164 1/20 0.36
TRIM33 Q9UPN9 1/20 0.36
PIK3C3 Q8NEB9 3/20 0.36
MET P08581 1/20 0.34
KDR P35968 1/20 0.34
ACHE P22303 1/20 0.34
GRK2 P25098 1/20 0.34
PI4KB Q9UBF8 2/20 0.33
GNRHR P30968 1/20 0.33
FFAR1 O14842 1/20 0.33
BRD4 O60885 1/20 0.33
MAPK14 Q16539 1/20 0.33
AXL P30530 1/20 0.33
NAMPT P43490 1/20 0.33
AKT1 P31749 1/20 0.33
MEN1 O00255 1/20 0.32
POLB P06746 1/20 0.32
KMT2A Q03164 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
SCHEMBL21593135 0.92 TRIM24 (0.36) TRIM24TRIM33METKDRACHE
SCHEMBL21593107 0.92 PIK3C3 (0.38) TRIM24TRIM33PIK3C3ACHEBRD4
SCHEMBL21593139 0.89 TRIM24 (0.38) TRIM24TRIM33METKDRGNRHR
SCHEMBL21593171 0.87 SCD (0.36) METKDRGNRHRBRD4AXL
SCHEMBL21593083 0.84 AXL (0.35) METKDRBRD4AXLNAMPT
SCHEMBL21593176 0.82 CYP3A4 (0.35) AXLNAMPT
SCHEMBL21593242 0.81 MET (0.43) METKDRACHEAXLAKT1
SCHEMBL21593064 0.79 MET (0.40) METKDRBRD4AXLNAMPT
SCHEMBL21593174 0.79 TBK1 (0.34) METAXLNAMPT
SCHEMBL21593076 0.79 ACHE (0.39) PIK3C3ACHENAMPTMEN1KMT2A

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-20210253568-A1 AZAINDOLE DERIVATIVES AS RHO-KINASE INHIBITORS CHIESI FARMACEUTICI S.P.A. (IT) 2021-08-19 US disclosed
WO-2019238628-A1 AZAINDOLE DERIVATIVES AS RHO- KINASE INHIBITORS CHIESI FARMACEUTICI S.P.A. (IT) 2019-12-19 WO 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 TRIM24 2144/4885TRIM33 2273/4885PIK3C3 808/4885

“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.