SCHEMBL3300310

SCHEMBL3300310

CC(C)(C)OC(=O)NCc1ccnc(-n2ccc3cc(N(C(C(=O)O)C(C)(C)C)S(=O)(=O)c4cc(Cl)cc(Cl)c4)ccc32)c1

nearest known ligand 0.33

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
BRD9 Q9H8M2 1/20 0.33
BAZ2B Q9UIF8 1/20 0.33
BAZ2A Q9UIF9 1/20 0.33
ROCK1 Q13464 2/20 0.33
IRAK4 Q9NWZ3 1/20 0.32
BRD4 O60885 1/20 0.32
NAMPT P43490 2/20 0.31
MAPK8 P45983 1/20 0.31
GNRHR P30968 1/20 0.30
POLB P06746 1/20 0.30
MAPK1 P28482 1/20 0.30
ATM Q13315 1/20 0.30
EPAS1 Q99814 1/20 0.30
ITGB1 P05556 1/20 0.30
ITGA4 P13612 1/20 0.30
CHRNA7 P36544 1/20 0.30
DGAT1 O75907 1/20 0.30

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
SCHEMBL10316933 0.86 ROCK1 (0.34) BRD9BAZ2BBAZ2AROCK1IRAK4
SCHEMBL13390674 0.86 BRD9 (0.33) BRD9BAZ2BBAZ2AROCK1IRAK4
SCHEMBL3295501 0.85 IRAK4 (0.31) IRAK4
SCHEMBL3301125 0.84 ROCK1 (0.34) ROCK1IRAK4DGAT1
SCHEMBL3298211 0.83 IRAK4 (0.34) IRAK4DGAT1
SCHEMBL3295593 0.83 IRAK4 (0.34) IRAK4BRD4
SCHEMBL3297377 0.83 ROCK1 (0.32) ROCK1IRAK4
SCHEMBL3302071 0.83 IRAK4 (0.32) IRAK4
SCHEMBL3298897 0.82 IRAK4 (0.31) IRAK4
SCHEMBL3298932 0.82 IRAK4 (0.31) IRAK4

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-20100093703-A1 SUBSTITUTED ARYLSULPHONYLGLYCINES, THE PREPARATION THEREOF AND THE USE THEREOF AS PHARMACEUTICAL COMPOSITIONS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-04-15 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-20100093703-A1 SUBSTITUTED ARYLSULPHONYLGLYCINES, THE PREPARATION THEREOF AND THE USE THEREOF AS PHARMACEUTICAL COMPOSITIONS PYGL, PYGM, G6PC1 BRD9 4579/4885BAZ2B 3584/4885BAZ2A 2535/4885

“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.