SCHEMBL162178

SCHEMBL162178

CC(C)(C)c1ccc(C(=O)Nc2ccc(-c3noc(C4CCC(OC=O)CC4)n3)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
MEN1 O00255 1/20 0.44
LMNA P02545 1/20 0.44
TSHR P16473 1/20 0.44
HTT P42858 1/20 0.44
KMT2A Q03164 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
HDAC4 P56524 3/20 0.44
ALDH1A1 P00352 1/20 0.44
HDAC6 Q9UBN7 1/20 0.44
MCHR1 Q99705 3/20 0.43
TRPV1 Q8NER1 3/20 0.43
KDM4E B2RXH2 2/20 0.43
MAPK1 P28482 2/20 0.43
GAA P10253 1/20 0.43
POLB P06746 1/20 0.43

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
SCHEMBL162177 0.85 S1PR4 (0.49) MAPTSMN1; SMN2MEN1LMNATSHR
SCHEMBL174329 0.85 S1PR4 (0.49) MAPTSMN1; SMN2MEN1LMNATSHR
SCHEMBL162122 0.83 MAPT (0.54) MAPTSMN1; SMN2MEN1LMNATSHR
SCHEMBL6370573 0.77 RAB9A (0.60) MAPTSMN1; SMN2LMNATSHRHTT
SCHEMBL174328 0.75 S1PR4 (0.49) MAPTSMN1; SMN2MEN1LMNATSHR
SCHEMBL174317 0.75 S1PR4 (0.49) MAPTSMN1; SMN2MEN1LMNATSHR
SCHEMBL162488 0.74 SCN10A (0.49) MAPTSMN1; SMN2MEN1LMNATSHR
SCHEMBL162574 0.74 SCN10A (0.49) MAPTSMN1; SMN2MEN1LMNATSHR
SCHEMBL15021866 0.73 HDAC4 (0.51) MAPTSMN1; SMN2MEN1LMNATSHR
SCHEMBL163930 0.73 HDAC4 (0.51) MAPTSMN1; SMN2MEN1LMNATSHR

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2611783-A2 HETEROCYCLIC COMPOUNDS AS DGAT1 INHIBITORS Piramal Enterprises Limited (IN) 2013-07-10 EP claimed
US-20130158075-A1 HETEROCYCLIC COMPOUNDS AS DGAT1 INHIBITORS Piramal Enterprises Limited (IN) 2013-06-20 US claimed
WO-2012029032-A2 HETEROCYCLIC COMPOUNDS AS DGAT1 INHIBITORS PIRAMAL LIFE SCIENCES LIMITED (IN) 2012-03-08 WO claimed
EP-2611783-A2 HETEROCYCLIC COMPOUNDS AS DGAT1 INHIBITORS Piramal Enterprises Limited (IN) 2013-07-10 EP disclosed
US-20130158075-A1 HETEROCYCLIC COMPOUNDS AS DGAT1 INHIBITORS Piramal Enterprises Limited (IN) 2013-06-20 US disclosed
WO-2012029032-A2 HETEROCYCLIC COMPOUNDS AS DGAT1 INHIBITORS PIRAMAL LIFE SCIENCES LIMITED (IN) 2012-03-08 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-20130158075-A1 HETEROCYCLIC COMPOUNDS AS DGAT1 INHIBITORS DGAT1, DGAT2, SOAT1 MAPT 137/4885SMN1; SMN2 2105/4885MEN1 2803/4885

“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.