SCHEMBL181030

SCHEMBL181030

O=C(O)CCc1ccc(-c2ccc(-c3cnc(Nc4cccc(Cl)c4)o3)cc2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ DGAT1 O75907 2/20 1.00
▸ FFAR1 O14842 4/20 0.55
▸ KDR P35968 6/20 0.54
▸ FLT1 P17948 5/20 0.54
▸ FLT4 P35916 5/20 0.54
▸ SIRT7 Q9NRC8 1/20 0.54
▸ VCP P55072 3/20 0.51
▸ RXRA P19793 1/20 0.47
▸ RXRB P28702 1/20 0.47
▸ RXRG P48443 1/20 0.47
▸ SYK P43405 1/20 0.45
▸ MAP4K4 O95819 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
SCHEMBL180361 0.89 DGAT1 (0.81) DGAT1KDRFLT1FLT4SIRT7
SCHEMBL180503 0.87 DGAT1 (0.76) DGAT1FFAR1KDRFLT1FLT4
SCHEMBL180699 0.78 DGAT1 (0.64) DGAT1KDRFLT1FLT4SIRT7
SCHEMBL180696 0.78 DGAT1 (0.64) DGAT1KDRFLT1FLT4SIRT7
SCHEMBL16546763 0.78 DGAT1 (0.63) DGAT1KDRFLT1FLT4SIRT7
SCHEMBL180392 0.78 DGAT1 (0.63) DGAT1KDRFLT1FLT4SIRT7
SCHEMBL14617024 0.78 DGAT1 (0.63) DGAT1KDRFLT1FLT4SIRT7
SCHEMBL180766 0.77 SIRT7 (0.65) DGAT1KDRFLT1FLT4SIRT7
SCHEMBL180428 0.77 DGAT1 (1.00) DGAT1KDRFLT1FLT4SIRT7
SCHEMBL16546760 0.77 DGAT1 (0.64) DGAT1KDRFLT1FLT4SIRT7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2404905-A1 New compounds Novartis AG (CH) 2012-01-11 — — EP claimed
EP-2402320-A1 Anorectic agents Novartis AG (CH) 2012-01-04 — — EP claimed
EP-2301923-A1 New compounds Novartis AG (CH) 2011-03-30 — — EP claimed
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
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-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
WO-2008073865-A2 METHOD OF PREVENTING OR TREATING MYOCARDIAL ISCHEMIA NOVARTIS AG (CH) 2008-06-19 — — 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 1/4885FFAR1 1204/4885KDR 4520/4885
US-20100016387-A1 METHOD OF TREATMENT DGAT1, DGAT2, DGKA DGAT1 1/4885FFAR1 848/4885KDR 3874/4885
US-20130018054-A1 NEW COMPOUNDS DGAT1, DGAT2, GBA1 DGAT1 1/4885FFAR1 1234/4885KDR 4537/4885
US-20130018074-A1 NEW COMPOUNDS DGAT1, DGAT2, GBA1 DGAT1 1/4885FFAR1 1234/4885KDR 4537/4885

“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.

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