SCHEMBL3177984

SCHEMBL3177984

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

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 2/20 0.58
KDR P35968 2/20 0.58
PDGFRB P09619 1/20 0.58
HRH4 Q9H3N8 5/20 0.52
ATR Q13535 2/20 0.51
HDAC3 O15379 2/20 0.50
HDAC6 Q9UBN7 2/20 0.50
HDAC7 Q8WUI4 1/20 0.50
HDAC9 Q9UKV0 1/20 0.50
FGFR2 P21802 1/20 0.49
FGFR3 P22607 1/20 0.49
HSP90AA1 P07900 1/20 0.49
ESR2 Q92731 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
HRH3 Q9Y5N1 1/20 0.48
FASN P49327 1/20 0.48
NR4A2 P43354 1/20 0.46
ALOX15 P16050 1/20 0.46
ALDH1A1 P00352 1/20 0.46
MAPT P10636 1/20 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
SCHEMBL1250947 0.84 DGAT1 (0.68) FGFR1KDRPDGFRBHRH4ATR
SCHEMBL3168348 0.83 DGAT1 (0.54) FGFR1KDRPDGFRBATRHDAC3
SCHEMBL3172174 0.79 HDAC3 (0.75) HDAC3HDAC6HDAC7HDAC9HSP90AA1
SCHEMBL17468532 0.78 HRH4 (0.62) FGFR1KDRPDGFRBHRH4FGFR2
SCHEMBL1251774 0.78 DGAT1 (0.65) HDAC3HDAC6HDAC7HDAC9HSP90AA1
SCHEMBL1252797 0.77 SIRT2 (0.59) FGFR1KDRPDGFRBHDAC3HDAC6
SCHEMBL3167982 0.76 DGAT1 (0.68) HDAC3HDAC6HDAC7HDAC9HSP90AA1
SCHEMBL3162874 0.75 HDAC3 (0.56) HDAC3HDAC6HDAC7HDAC9HSP90AA1
SCHEMBL3168092 0.75 DGAT1 (0.56) HDAC3HDAC6HDAC7HDAC9HSP90AA1
SCHEMBL3178094 0.75 CHEK2 (0.61) HDAC3HDAC6HDAC7HDAC9HSP90AA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8222248-B2 Organic compounds NOVARTIS AG (CH) 2012-07-17 US 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
CN-101600437-A method for preventing or treating myocardial ischemia NOVARTIS AG (CH) 2009-12-09 CN 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 FGFR1 3321/4885KDR 3874/4885PDGFRB 3587/4885

“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.