SCHEMBL181069

SCHEMBL181069

CC(C)(C)OC(=O)N1CCC(c2ccc(-c3ccc(Nc4ccc(C(F)(F)F)nc4)nc3)cc2)CC1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DDB1 Q16531 1/20 0.50
CRBN Q96SW2 1/20 0.50
WNT3A P56704 1/20 0.49
JAK3 P52333 4/20 0.49
PTK2 Q05397 3/20 0.49
JAK2 O60674 2/20 0.49
NAMPT P43490 1/20 0.48
PTPN2 P17706 1/20 0.47
PTPN1 P18031 1/20 0.47
PTPN6 P29350 1/20 0.47
GPR119 Q8TDV5 7/20 0.47
DGAT1 O75907 1/20 0.47
SYK P43405 1/20 0.46
P2RY14 Q15391 1/20 0.46
IGF1R P08069 1/20 0.44
LCK P06239 1/20 0.44
BTK Q06187 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
SCHEMBL27758109 0.87 DGAT1 (0.47) DDB1CRBNWNT3AJAK3PTK2
SCHEMBL180730 0.86 DGAT1 (0.52) DGAT1
SCHEMBL180828 0.84 DGAT1 (0.47) WNT3ADGAT1
SCHEMBL25598233 0.82 DDB1 (0.58) DDB1CRBNWNT3ANAMPTGPR119
SCHEMBL180746 0.79 DGAT1 (0.56) DGAT1SYK
SCHEMBL4323884 0.79 DGAT1 (0.48) PTPN1DGAT1
SCHEMBL31615976 0.78 GPR119 (0.50) DDB1CRBNJAK3PTK2NAMPT
Tert-Butyl Formate SCHEMBL27758111 0.78 DGAT1 (0.45) PTK2DGAT1
SCHEMBL4323880 0.78 DGAT1 (0.49) JAK2DGAT1
SCHEMBL180830 0.77 DGAT1 (0.76) DGAT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150065517-A1 NEW COMPOUNDS NOVARTIS AG (CH) 2015-03-05 US disclosed
US-8912208-B2 (4-{4-[5-(benzooxazol-2-ylamino)-pyridin-2-yl]-phenyl}-cyclohexyl)-acetic acid useful for treating or preventing conditions or disorders associated with DGAT1 activity NOVARTIS AG (CH) 2014-12-16 US disclosed
US-8835451-B2 Compounds NOVARTIS AG (CH) 2014-09-16 US disclosed
EP-2418202-B1 (4-[4-[5-(substituted amino)-pyridin-2-yl]phenyl]-cyclohexyl)-acetic acid derivatives as DGAT inhibitors NOVARTIS AG (CH) 2014-01-29 EP disclosed
US-20130018054-A1 NEW COMPOUNDS NOVARTIS AG (CH) 2013-01-17 US disclosed
US-20130018074-A1 NEW COMPOUNDS NOVARTIS AG (CH) 2013-01-17 US disclosed
EP-2418202-A1 New compounds Novartis AG (CH) 2012-02-15 EP disclosed
EP-2404905-A1 New compounds Novartis AG (CH) 2012-01-11 EP disclosed
EP-2402319-A1 DGAT Inhibitors Novartis AG (CH) 2012-01-04 EP disclosed
EP-2402320-A1 Anorectic agents Novartis AG (CH) 2012-01-04 EP disclosed
EP-2402318-A1 DGAT inhibitors Novartis AG (CH) 2012-01-04 EP disclosed
EP-2402317-A1 DGAT inhibitor Novartis AG (CH) 2012-01-04 EP disclosed
EP-2301923-A1 New compounds Novartis AG (CH) 2011-03-30 EP disclosed
US-20090247534-A1 NEW COMPOUNDS NOVARTIS AG (CH) 2009-10-01 US disclosed
EP-2004607-A2 NEW COMPOUNDS Novartis AG (CH) 2008-12-24 EP disclosed
WO-2007126957-A2 NEW COMPOUNDS NOVARTIS AG (CH) 2007-11-08 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 (4 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-20150065517-A1 NEW COMPOUNDS DGAT1, DGAT2, GBA1 DDB1 108/4885CRBN 4290/4885WNT3A 4003/4885
US-20090247534-A1 NEW COMPOUNDS DGAT1, DGAT2, GBA1 DDB1 108/4885CRBN 4290/4885WNT3A 4003/4885
US-20130018054-A1 NEW COMPOUNDS DGAT1, DGAT2, GBA1 DDB1 105/4885CRBN 4181/4885WNT3A 4007/4885
US-20130018074-A1 NEW COMPOUNDS DGAT1, DGAT2, GBA1 DDB1 105/4885CRBN 4181/4885WNT3A 4007/4885

“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.