SCHEMBL13409592

SCHEMBL13409592

O=C(O)CN(Sc1cc(Cl)cc(Cl)c1)c1ccc2c(ccn2-c2ncccn2)c1

nearest known ligand 0.32

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ROCK2 O75116 1/20 0.32
PIM1 P11309 1/20 0.32
PIM3 Q86V86 1/20 0.32
DGAT1 O75907 2/20 0.32
FFAR4 Q5NUL3 1/20 0.31
MGLL Q99685 1/20 0.31
OXER1 Q8TDS5 1/20 0.31
ROCK1 Q13464 2/20 0.31
RPS6KA5 O75582 1/20 0.30
RPS6KA4 O75676 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
SCHEMBL13409162 0.87 DGAT1 (0.36) DGAT1
SCHEMBL13409421 0.85 HPGD (0.34) DGAT1ROCK1
SCHEMBL13408614 0.83 DGAT1 (0.38) ROCK2PIM1PIM3DGAT1OXER1
SCHEMBL14107959 0.82 CDC7 (0.40) FFAR4ROCK1
SCHEMBL13409632 0.81 ROCK2 (0.33) ROCK2PIM1PIM3DGAT1ROCK1
SCHEMBL13409510 0.81 DGAT1 (0.33) DGAT1
SCHEMBL13408613 0.81 ROCK2 (0.55) ROCK2PIM1PIM3DGAT1
SCHEMBL14107958 0.81 ROCK2 (0.30) ROCK2PIM1PIM3
SCHEMBL13408628 0.80 ROCK1 (0.36) ROCK1
SCHEMBL13409211 0.80 KMT2A (0.33) ROCK2PIM1PIM3FFAR4

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-20100093703-A1 SUBSTITUTED ARYLSULPHONYLGLYCINES, THE PREPARATION THEREOF AND THE USE THEREOF AS PHARMACEUTICAL COMPOSITIONS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-04-15 US disclosed
WO-2008099000-A2 SUBSTITUTED ARYLSULPHONYLGLYCINES, THE PREPARATION THEREOF AND THE USE THEREOF AS PHARMACEUTICAL COMPOSITIONS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2008-08-21 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-20100093703-A1 SUBSTITUTED ARYLSULPHONYLGLYCINES, THE PREPARATION THEREOF AND THE USE THEREOF AS PHARMACEUTICAL COMPOSITIONS PYGL, PYGM, G6PC1 ROCK2 1978/4885PIM1 600/4885PIM3 981/4885

“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.