SCHEMBL3175587

SCHEMBL3175587

O=C(O)[C@@H]1CCCCN1C(=O)c1ccccn1

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 9/20 0.54
L3MBTL1 Q9Y468 2/20 0.53
EPHX2 P34913 1/20 0.50
TDP1 Q9NUW8 1/20 0.48
ALDH1A1 P00352 2/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
TSHR P16473 1/20 0.47
PDE10A Q9Y233 1/20 0.45
GRM5 P41594 1/20 0.45

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
SCHEMBL3178325 1.00 DGAT1 (0.54) DGAT1L3MBTL1EPHX2TDP1ALDH1A1
SCHEMBL3178211 1.00 DGAT1 (0.54) DGAT1L3MBTL1EPHX2TDP1ALDH1A1
SCHEMBL3168169 0.96 DGAT1 (0.58) DGAT1L3MBTL1EPHX2ALDH1A1SMN1; SMN2
SCHEMBL3168186 0.96 DGAT1 (0.58) DGAT1L3MBTL1EPHX2ALDH1A1SMN1; SMN2
SCHEMBL4927632 0.83 L3MBTL1 (0.53) DGAT1L3MBTL1EPHX2GRM5
SCHEMBL25793389 0.83 L3MBTL1 (0.53) DGAT1L3MBTL1EPHX2ALDH1A1GRM5
SCHEMBL25793395 0.83 L3MBTL1 (0.53) DGAT1L3MBTL1EPHX2ALDH1A1GRM5
SCHEMBL4927636 0.83 L3MBTL1 (0.53) DGAT1L3MBTL1EPHX2GRM5
SCHEMBL4504302 0.82 ALDH1A1 (0.50) DGAT1L3MBTL1TDP1ALDH1A1GRM5
SCHEMBL11224117 0.82 ACE (0.54) ALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102119047-B Heteroaryl derivatives as DGAT1 inhibitors NOVARTIS AG 2014-09-24 CN disclosed
US-8703761-B2 Organic compounds NOVARTIS AG (CH) 2014-04-22 US disclosed
EP-2559455-A1 Heteroaryl derivatives as DGAT1 inhibitors Novartis AG (CH) 2013-02-20 EP disclosed
EP-2548618-A2 Organic compounds Novartis AG (CH) 2013-01-23 EP disclosed
CN-102119047-A Heteroaryl derivatives as DGAT1 inhibitors NOVARTIS AG 2011-07-06 CN disclosed
US-20100022513-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2010-01-28 US 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 (1 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-20100022513-A1 ORGANIC COMPOUNDS DGAT1, DGAT2, SOAT1 DGAT1 1/4885L3MBTL1 1161/4885EPHX2 771/4885

“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.