SCHEMBL180880

SCHEMBL180880

COC(=O)CC1CCC(c2ccc(-c3ccc(Nc4nc5ccccc5o4)cn3)cc2)CC1

nearest known ligand 0.58

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 14/20 0.58
USP2 O75604 1/20 0.40
MAPT P10636 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
PDE4D Q08499 1/20 0.39
PDE10A Q9Y233 1/20 0.39
NPC1 O15118 1/20 0.38
ALDH1A1 P00352 1/20 0.38
PKM P14618 1/20 0.38
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HCRTR1 O43613 1/20 0.38
HCRTR2 O43614 1/20 0.38

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
SCHEMBL15872177 1.00 DGAT1 (0.58) DGAT1USP2MAPTTDP1PDE4D
SCHEMBL13664077 0.91 DGAT1 (0.68) DGAT1
SCHEMBL19292677 0.91 DGAT1 (0.68) DGAT1
SCHEMBL14617030 0.91 DGAT1 (0.68) DGAT1
SCHEMBL180819 0.91 DGAT1 (0.68) DGAT1
SCHEMBL15872159 0.90 DGAT1 (0.67) DGAT1
Potassium Ion SCHEMBL15872163 0.89 DGAT1 (0.58) DGAT1PDE4DPDE10ANPC1ALDH1A1
SCHEMBL15872161 0.89 DGAT1 (0.58) DGAT1PDE4DPDE10ANPC1ALDH1A1
Potassium Ion SCHEMBL15872162 0.89 DGAT1 (0.58) DGAT1PDE4DPDE10ANPC1ALDH1A1
SCHEMBL15872172 0.89 DGAT1 (0.58) DGAT1PDE4DPDE10ANPC1ALDH1A1

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 24 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2943488-B1 MEGLUMINE SALT FORMS OF 2-((1 R,4R)-4-(4-(5-(BENZOXAZOL-2-YLAMINO)PYRIDIN-2-YL)PHENYL)CYCLOHEXYL) ACETIC ACID AND THEIR USE AS DGAT1 INHIBITORS NOVARTIS AG (CH) 2018-03-28 EP disclosed
EP-2402319-B1 DGAT Inhibitors NOVARTIS AG (CH) 2017-08-30 EP disclosed
US-9242971-B2 Compounds for the treatment of conditions associated with DGAT1 activity NOVARTIS AG (CH) 2016-01-26 US disclosed
EP-2943488-A1 MEGLUMINE SALT FORMS OF 2-((1 R,4R)-4-(4-(5-(BENZOXAZOL-2-YLAMINO)PYRIDIN-2-YL)PHENYL)CYCLOHEXYL) ACETIC ACID AND THEIR USE AS DGAT1 INHIBITORS Novartis AG (CH) 2015-11-18 EP disclosed
US-20150166522-A1 COMPOUNDS FOR THE TREATMENT OF CONDITIONS ASSOCIATED WITH DGAT1 ACTIVITY NOVARTIS AG (CH) 2015-06-18 US disclosed
US-8987459-B2 Compounds for the treatment of conditions associated with DGAT1 activity NOVARTIS AG (CH) 2015-03-24 US disclosed
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
US-20140200246-A1 COMPOUNDS FOR THE TREATMENT OF CONDITIONS ASSOCIATED WITH DGAT1 ACTIVITY NOVARTIS AG (CH) 2014-07-17 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 DGAT1 1/4885USP2 3633/4885MAPT 1739/4885
US-20090247534-A1 NEW COMPOUNDS DGAT1, DGAT2, GBA1 DGAT1 1/4885USP2 3633/4885MAPT 1739/4885
US-20140200246-A1 COMPOUNDS FOR THE TREATMENT OF CONDITIONS ASSOCIATED WITH DGAT1 ACTIVITY DGAT1, DGAT2, GBA1 DGAT1 1/4885USP2 3268/4885MAPT 647/4885
US-20150166522-A1 COMPOUNDS FOR THE TREATMENT OF CONDITIONS ASSOCIATED WITH DGAT1 ACTIVITY DGAT1, DGAT2, GBA1 DGAT1 1/4885USP2 3268/4885MAPT 647/4885

“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.