SCHEMBL14848176

SCHEMBL14848176

NCCCCc1nc(-c2ccc(Cl)c(Cl)c2)no1

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ SIRT2 Q8IXJ6 6/20 0.51
▸ NOTUM Q6P988 1/20 0.49
▸ ALDH1A1 P00352 1/20 0.48
▸ CASP3 P42574 1/20 0.46
▸ LIPG Q9Y5X9 1/20 0.46
▸ TDP1 Q9NUW8 3/20 0.46
▸ HDAC2 Q92769 2/20 0.45
▸ HDAC1 Q13547 1/20 0.45
▸ L3MBTL1 Q9Y468 2/20 0.45
▸ HDAC8 Q9BY41 1/20 0.44
▸ CA12 O43570 1/20 0.44
▸ CA1 P00915 1/20 0.44
▸ CA2 P00918 1/20 0.44
▸ CA9 Q16790 1/20 0.44
▸ MAPT P10636 2/20 0.44
▸ LMNA P02545 1/20 0.44
▸ HTT P42858 1/20 0.44
▸ HPGD P15428 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
SCHEMBL28432697 0.80 HRH3 (0.60) SIRT2ALDH1A1LIPGMAPTLMNA
SCHEMBL28435949 0.79 HRH3 (0.62) SIRT2LIPGLMNAHTT
SCHEMBL28428261 0.78 HRH3 (0.56) SIRT2ALDH1A1LIPGMAPTLMNA
SCHEMBL1545132 0.78 TDP1 (0.54) SIRT2NOTUMALDH1A1TDP1L3MBTL1
SCHEMBL28428242 0.77 HRH3 (0.57) SIRT2ALDH1A1LIPGMAPTLMNA
SCHEMBL28428276 0.76 ALDH1A1 (0.55) SIRT2ALDH1A1L3MBTL1MAPTLMNA
SCHEMBL26887359 0.76 L3MBTL1 (0.49) SIRT2TDP1L3MBTL1MAPTLMNA
SCHEMBL28896081 0.75 RAB9A (0.56) SIRT2ALDH1A1LIPGL3MBTL1LMNA
SCHEMBL26887830 0.74 SIRT2 (0.47) SIRT2NOTUMALDH1A1TDP1L3MBTL1
SCHEMBL26887360 0.74 SIRT2 (0.50) SIRT2TDP1HDAC2L3MBTL1HDAC8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2760839-B1 PYRIDINEDIONE CARBOXAMIDE INHIBITORS OF ENDOTHELIAL LIPASE BRISTOL MYERS SQUIBB CO (US) 2015-11-25 — — EP disclosed
EP-2760839-B1 PYRIDINEDIONE CARBOXAMIDE INHIBITORS OF ENDOTHELIAL LIPASE BRISTOL MYERS SQUIBB CO (US) 2015-11-25 — — EP disclosed
US-8993557-B2 Pyridinedione carboxamide inhibitors of endothelial lipase BRISTOL-MYERS SQUIBB COMPANY (US) 2015-03-31 — — US disclosed
US-8993557-B2 Pyridinedione carboxamide inhibitors of endothelial lipase BRISTOL-MYERS SQUIBB COMPANY (US) 2015-03-31 — — US disclosed
US-8993557-B2 Pyridinedione carboxamide inhibitors of endothelial lipase BRISTOL-MYERS SQUIBB COMPANY (US) 2015-03-31 — — US disclosed
US-20140235608-A1 PYRIDINEDIONE CARBOXAMIDE INHIBITORS OF ENDOTHELIAL LIPASE BRISTOL-MYERS SQUIBB COMPANY (US) 2014-08-21 — — US disclosed
US-20140235608-A1 PYRIDINEDIONE CARBOXAMIDE INHIBITORS OF ENDOTHELIAL LIPASE BRISTOL-MYERS SQUIBB COMPANY (US) 2014-08-21 — — US disclosed
US-20140235608-A1 PYRIDINEDIONE CARBOXAMIDE INHIBITORS OF ENDOTHELIAL LIPASE BRISTOL-MYERS SQUIBB COMPANY (US) 2014-08-21 — — US disclosed
WO-2013049104-A1 PYRIDINEDIONE CARBOXAMIDE INHIBITORS OF ENDOTHELIAL LIPASE BRISTOL-MYERS SQUIBB COMPANY (US) 2013-04-04 — — 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 (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-20140235608-A1 PYRIDINEDIONE CARBOXAMIDE INHIBITORS OF ENDOTHELIAL LIPASE LIPG, PNLIP, LPL SIRT2 614/4885NOTUM 41/4885ALDH1A1 401/4885

“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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