SCHEMBL180521

SCHEMBL180521

O=C(O)c1ccc(-c2ccc(Nc3cccc(Cl)c3)nn2)cc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 1/20 0.71
CAMK2D Q13557 1/20 0.61
NPC1 O15118 4/20 0.52
RAB9A P51151 4/20 0.52
ALDH1A1 P00352 3/20 0.52
MEN1 O00255 1/20 0.52
KMT2A Q03164 1/20 0.52
AKR1C3 P42330 1/20 0.45
AKR1C2 P52895 1/20 0.45
KDR P35968 1/20 0.45
GSK3B P49841 2/20 0.45
MAPK8 P45983 1/20 0.45
PIK3CG P48736 1/20 0.45
CAMKK2 Q96RR4 1/20 0.45
CSNK2A1 P68400 6/20 0.44
CSNK2A2 P19784 5/20 0.44
CSNK2B P67870 5/20 0.44
MAPT P10636 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
LMNA P02545 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
SCHEMBL8024017 0.85 DGAT1 (0.61) DGAT1NPC1RAB9AALDH1A1MEN1
SCHEMBL180660 0.84 DGAT1 (1.00) DGAT1CAMK2DNPC1RAB9AALDH1A1
SCHEMBL180780 0.84 DGAT1 (0.66) DGAT1CAMK2DNPC1RAB9AALDH1A1
SCHEMBL181070 0.82 DGAT1 (0.64) DGAT1CAMK2DNPC1RAB9AALDH1A1
SCHEMBL27758085 0.80 DGAT1 (0.59) DGAT1CAMK2DNPC1RAB9AALDH1A1
SCHEMBL180744 0.80 DGAT1 (0.61) DGAT1CAMK2DNPC1RAB9AALDH1A1
SCHEMBL4591870 0.80 DGAT1 (0.61) DGAT1CAMK2DNPC1RAB9AALDH1A1
SCHEMBL180781 0.80 DGAT1 (0.61) DGAT1CAMK2DNPC1RAB9AALDH1A1
SCHEMBL180569 0.79 DGAT1 (0.55) DGAT1CAMK2DNPC1RAB9AALDH1A1
SCHEMBL180568 0.79 DGAT1 (0.55) DGAT1CAMK2DNPC1RAB9AALDH1A1

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-20130018074-A1 NEW COMPOUNDS NOVARTIS AG (CH) 2013-01-17 US disclosed
US-20130018054-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-2402317-A1 DGAT inhibitor Novartis AG (CH) 2012-01-04 EP disclosed
EP-2402320-A1 Anorectic agents Novartis AG (CH) 2012-01-04 EP disclosed
EP-2402319-A1 DGAT Inhibitors Novartis AG (CH) 2012-01-04 EP disclosed
EP-2402318-A1 DGAT inhibitors 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 DGAT1 1/4885CAMK2D 3305/4885NPC1 17/4885
US-20090247534-A1 NEW COMPOUNDS DGAT1, DGAT2, GBA1 DGAT1 1/4885CAMK2D 3305/4885NPC1 17/4885
US-20130018054-A1 NEW COMPOUNDS DGAT1, DGAT2, GBA1 DGAT1 1/4885CAMK2D 3297/4885NPC1 16/4885
US-20130018074-A1 NEW COMPOUNDS DGAT1, DGAT2, GBA1 DGAT1 1/4885CAMK2D 3297/4885NPC1 16/4885

“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.