SCHEMBL13409145

SCHEMBL13409145

CC(C)(C)OC(=O)CN(Sc1cc(Cl)cc(Cl)c1)c1ccc2c(ccn2-c2ccc(OCc3ccccc3)nn2)c1

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 2/20 0.34
ROCK1 Q13464 3/20 0.34
GPR119 Q8TDV5 1/20 0.34
SRD5A2 P31213 1/20 0.31
CYP2C9 P11712 1/20 0.30
PTGER1 P34995 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
SCHEMBL13390781 0.85 GPR119 (0.38) DGAT1ROCK1GPR119
SCHEMBL13409162 0.81 DGAT1 (0.36) DGAT1
SCHEMBL14107625 0.81 DGAT1 (0.35) DGAT1
SCHEMBL13409480 0.80 DGAT1 (0.36) DGAT1GPR119
SCHEMBL13409538 0.79 DGAT1 (0.34) DGAT1
SCHEMBL14107592 0.79 DGAT1 (0.35) DGAT1
SCHEMBL11956402 0.78 RORC (0.38)
SCHEMBL11956681 0.78 OXER1 (0.35)
SCHEMBL13409155 0.78 DGAT1 (0.37) DGAT1
SCHEMBL13409182 0.78 DGAT1 (0.34) DGAT1

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 DGAT1 3856/4885ROCK1 712/4885GPR119 177/4885

“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.