SCHEMBL161554

SCHEMBL161554

Cc1ccc(F)c(NC(=O)Nc2ccc(-c3cnc(C4CCC(OC=O)CC4)s3)cc2)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.48
MAPT P10636 2/20 0.48
RAB9A P51151 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
PKM P14618 1/20 0.48
KDR P35968 17/20 0.47
PDGFRB P09619 7/20 0.47
KIT P10721 4/20 0.46
FLT3 P36888 4/20 0.46
CSF1R P07333 3/20 0.46
LYN P07948 3/20 0.46
FLT1 P17948 3/20 0.46
FLT4 P35916 3/20 0.46
BLK P51451 3/20 0.46
AURKA O14965 2/20 0.46
ROCK2 O75116 2/20 0.46
RPS6KA5 O75582 2/20 0.46
RET P07949 2/20 0.46
FGFR1 P11362 2/20 0.46
FGFR3 P22607 2/20 0.46

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
SCHEMBL161468 0.91 DGAT1 (0.42) NPC1MAPTRAB9ASMN1; SMN2PKM
SCHEMBL15022085 0.90 DGAT1 (0.55) NPC1MAPTRAB9ASMN1; SMN2PKM
SCHEMBL163071 0.88 DGAT1 (0.44) NPC1MAPTRAB9ASMN1; SMN2KDR
SCHEMBL173286 0.87 KDR (0.49) NPC1MAPTRAB9ASMN1; SMN2PKM
SCHEMBL162774 0.87 DGAT1 (0.43) MAPTDGAT1NTRK1
SCHEMBL161553 0.87 DGAT1 (0.59) NPC1MAPTRAB9ASMN1; SMN2PKM
SCHEMBL162781 0.86 DGAT1 (0.47) MAPTSMN1; SMN2KDRTEKDGAT1
SCHEMBL162339 0.86 MAPT (0.42) MAPTPKMKDRFLT3AURKA
SCHEMBL164678 0.86 DGAT1 (0.56) NPC1MAPTRAB9ASMN1; SMN2DGAT1
SCHEMBL162085 0.85 DGAT1 (0.53) KDRPDGFRBKITAURKATEK

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 NPC1 86/4885MAPT 137/4885RAB9A 1781/4885

“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.