SCHEMBL3168348

SCHEMBL3168348

Cc1cc(OCC(=O)N2CCN(C)CC2)cc(C)c1-c1nc2ccc(C(=O)O)cc2[nH]1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 3/20 0.54
FGFR1 P11362 2/20 0.47
KDR P35968 2/20 0.47
FGFR2 P21802 1/20 0.47
FGFR3 P22607 1/20 0.47
PDGFRB P09619 1/20 0.46
HDAC3 O15379 2/20 0.45
HDAC6 Q9UBN7 2/20 0.45
HDAC7 Q8WUI4 1/20 0.45
HDAC9 Q9UKV0 1/20 0.45
KDM4E B2RXH2 1/20 0.44
MEN1 O00255 1/20 0.44
NPC1 O15118 1/20 0.44
ALDH1A1 P00352 1/20 0.44
TP53 P04637 1/20 0.44
HPGD P15428 1/20 0.44
TSHR P16473 1/20 0.44
MAPK1 P28482 1/20 0.44
RAB9A P51151 1/20 0.44
KMT2A Q03164 1/20 0.44

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
SCHEMBL3168092 0.93 DGAT1 (0.56) DGAT1HDAC3HDAC6HDAC7HDAC9
SCHEMBL1251312 0.86 DGAT1 (0.75) DGAT1FGFR1KDRFGFR2FGFR3
SCHEMBL3177984 0.83 FGFR1 (0.58) FGFR1KDRFGFR2FGFR3PDGFRB
SCHEMBL3162726 0.82 DGAT1 (0.61) DGAT1HDAC3HDAC6HDAC7HDAC9
SCHEMBL1250566 0.81 DGAT1 (0.63) DGAT1HDAC3HDAC6HDAC7HDAC9
SCHEMBL3178094 0.81 CHEK2 (0.61) DGAT1HDAC3HDAC6HDAC7HDAC9
SCHEMBL3171341 0.81 DGAT1 (0.62) DGAT1HDAC3HDAC6HDAC7HDAC9
SCHEMBL3175814 0.81 DGAT1 (0.59) DGAT1HDAC3HDAC6HDAC7HDAC9
SCHEMBL15252558 0.80 DGAT1 (0.57) DGAT1KDM4EMEN1NPC1ALDH1A1
SCHEMBL1251668 0.78 DGAT1 (0.77) DGAT1HDAC3HDAC6HDAC7HDAC9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2074089-B1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2013-09-18 EP claimed
US-8222248-B2 Organic compounds NOVARTIS AG (CH) 2012-07-17 US claimed
EP-2074089-A2 ORGANIC COMPOUNDS Novartis AG (CH) 2009-07-01 EP claimed
WO-2008048991-A2 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2008-04-24 WO claimed
EP-2074089-B1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2013-09-18 EP disclosed
US-8222248-B2 Organic compounds NOVARTIS AG (CH) 2012-07-17 US disclosed
US-20100016387-A1 METHOD OF TREATMENT BOSE AVIRUP 2010-01-21 US disclosed
EP-2101783-A2 METHOD OF PREVENTING OR TREATING MYOCARDIAL ISCHEMIA Novartis Ag (CH) 2009-09-23 EP disclosed
WO-2009112445-A1 METHOD OF INCREASING CELLULAR PHOSPHATIDYL CHOLINE BY DGAT1 INHIBITION NOVARTIS AG (CH) 2009-09-17 WO disclosed
EP-2074089-A2 ORGANIC COMPOUNDS Novartis AG (CH) 2009-07-01 EP disclosed
WO-2008073865-A2 METHOD OF PREVENTING OR TREATING MYOCARDIAL ISCHEMIA NOVARTIS AG (CH) 2008-06-19 WO disclosed
WO-2008048991-A2 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2008-04-24 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-20100016387-A1 METHOD OF TREATMENT DGAT1, DGAT2, DGKA DGAT1 1/4885FGFR1 3321/4885KDR 3874/4885

“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.