SCHEMBL1249943

SCHEMBL1249943

Cc1ccccc1NC(=O)c1ccc2nc(-c3c(Cl)cccc3Cl)[nH]c2c1

nearest known ligand 0.69

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ DGAT1 O75907 8/20 0.69
▸ CYP3A4 P08684 1/20 0.61
▸ HDAC3 O15379 1/20 0.53
▸ HDAC7 Q8WUI4 1/20 0.53
▸ HDAC6 Q9UBN7 1/20 0.53
▸ HDAC9 Q9UKV0 1/20 0.53
▸ MEN1 O00255 1/20 0.52
▸ KMT2A Q03164 1/20 0.52
▸ LMNA P02545 1/20 0.51
▸ MAPT P10636 3/20 0.50
▸ NPC1 O15118 2/20 0.50
▸ RAB9A P51151 2/20 0.50
▸ TP53 P04637 2/20 0.50
▸ NR2E3 Q9Y5X4 1/20 0.50
▸ SMN1; SMN2 Q16637 1/20 0.50
▸ PRSS12 P56730 2/20 0.48

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
SCHEMBL1250958 0.87 DGAT1 (0.69) DGAT1CYP3A4HDAC3HDAC6NPC1
SCHEMBL1250144 0.87 DGAT1 (0.69) DGAT1CYP3A4HDAC3HDAC6MEN1
SCHEMBL1248743 0.87 DGAT1 (0.65) DGAT1CYP3A4HDAC6MEN1KMT2A
SCHEMBL1251453 0.85 DGAT1 (0.66) DGAT1CYP3A4HDAC3HDAC7HDAC6
SCHEMBL1249930 0.84 DGAT1 (0.85) DGAT1CYP3A4HDAC3HDAC6MEN1
SCHEMBL1249204 0.84 DGAT1 (0.77) DGAT1CYP3A4HDAC3HDAC7HDAC6
SCHEMBL1250412 0.84 DGAT1 (0.82) DGAT1CYP3A4HDAC3HDAC7HDAC6
SCHEMBL1251539 0.84 DGAT1 (0.84) DGAT1CYP3A4HDAC3HDAC7HDAC6
SCHEMBL1250413 0.84 DGAT1 (0.77) DGAT1CYP3A4HDAC3HDAC7HDAC6
SCHEMBL1249203 0.84 DGAT1 (0.77) DGAT1CYP3A4HDAC6NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2074089-B1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2013-09-18 — — EP claimed
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-8222248-B2 Organic compounds NOVARTIS AG (CH) 2012-07-17 — — US disclosed
US-20110046133-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2011-02-24 — — US disclosed
US-20110046133-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2011-02-24 — — US 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 (2 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-20110046133-A1 ORGANIC COMPOUNDS DGAT1, DGAT2, SOAT1 DGAT1 1/4885CYP3A4 2887/4885HDAC3 882/4885
US-20100016387-A1 METHOD OF TREATMENT DGAT1, DGAT2, DGKA DGAT1 1/4885CYP3A4 4050/4885HDAC3 176/4885

“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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