SCHEMBL162274

SCHEMBL162274

COC(=O)C(C)(C)Cc1ncc(-c2ccc(NC(=O)Nc3ccc(C(F)(F)F)cc3)cc2)s1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 1/20 0.45
EPHX2 P34913 2/20 0.45
KDR P35968 2/20 0.43
MAPK14 Q16539 1/20 0.42
P2RY1 P47900 2/20 0.41
NTRK1 P04629 3/20 0.41
NPC1 O15118 1/20 0.41
MAPT P10636 1/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
LMNA P02545 1/20 0.40
HTT P42858 1/20 0.40
CSNK1D P48730 1/20 0.40
BAZ1A Q9NRL2 1/20 0.40
MTOR P42345 1/20 0.40
FLT3 P36888 1/20 0.39

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
SCHEMBL164945 0.90 MAPT (0.44) DGAT1KDRMAPK14NTRK1NPC1
SCHEMBL164989 0.90 DGAT1 (0.48) DGAT1EPHX2KDRMAPK14P2RY1
SCHEMBL164317 0.88 CNR1 (0.47) NPC1MAPTMEN1KMT2ALMNA
SCHEMBL161964 0.84 DGAT1 (0.56) DGAT1MAPTLMNA
SCHEMBL162281 0.82 DGAT1 (0.54) DGAT1EPHX2KDRNPC1MAPT
SCHEMBL162156 0.82 DGAT1 (0.55) DGAT1KDRMAPK14NPC1MAPT
SCHEMBL158865 0.81 EPHX2 (0.51) EPHX2KDRNPC1
SCHEMBL157949 0.81 PTPN1 (0.50) DGAT1KDR
SCHEMBL164309 0.80 ERCC5 (0.40) NPC1MAPTMEN1KMT2ALMNA
SCHEMBL164809 0.80 MAPT (0.42) DGAT1KDRMAPK14NTRK1NPC1

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 DGAT1 1/4885EPHX2 712/4885KDR 4203/4885

“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.