SCHEMBL879375

SCHEMBL879375

N#CCC(=O)n1ccnc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 4/20 0.39
ALDH1A1 P00352 1/20 0.37
EGLN3 Q9H6Z9 1/20 0.35
MAPT P10636 1/20 0.35
MCL1 Q07820 1/20 0.32
WEE1 P30291 1/20 0.32
TBXAS1 P24557 4/20 0.32
BTN3A1 O00481 1/20 0.32
CA12 O43570 1/20 0.32
GGPS1 O95749 1/20 0.32
CA2 P00918 1/20 0.32
LMNA P02545 1/20 0.32
MMP2 P08253 1/20 0.32
FDPS P14324 1/20 0.32
MMP9 P14780 1/20 0.32
MMP8 P22894 1/20 0.32
MMP14 P50281 1/20 0.32
CA9 Q16790 1/20 0.32
CA14 Q9ULX7 1/20 0.32
FAAH O00519 1/20 0.31

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
SCHEMBL28410390 0.82 ALDH1A1 (0.38) CYP19A1ALDH1A1EGLN3MAPTWEE1
SCHEMBL9109216 0.78 CYP19A1 (0.37) CYP19A1ALDH1A1EGLN3MAPTWEE1
SCHEMBL6735760 0.77 ALDH1A1 (0.43) CYP19A1ALDH1A1EGLN3MAPTTBXAS1
SCHEMBL11463256 0.77 EGLN3 (0.45) ALDH1A1EGLN3MAPTWEE1TBXAS1
SCHEMBL8761373 0.75
SCHEMBL11181801 0.74
SCHEMBL1161357 0.74
SCHEMBL22117141 0.74 EGLN3 (0.42) ALDH1A1EGLN3WEE1TBXAS1
SCHEMBL5217912 0.74
SCHEMBL8283346 0.74

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2433989-B1 LIGHT-ABSORBING MATERIAL AND PHOTOELECTRIC CONVERSION ELEMENT PANASONIC CORP (JP) 2018-03-14 EP disclosed
EP-2504338-B1 PYRIDINE-PYRIDINONE DERIVATIVES, PREPARATION AND THERAPEUTIC USE THEREOF SANOFI SA (FR) 2015-03-18 EP disclosed
US-8729532-B2 Light-absorbing material and photoelectric conversion element PANASONIC CORPORATION (JP) 2014-05-20 US disclosed
US-8729532-B2 Light-absorbing material and photoelectric conversion element PANASONIC CORPORATION (JP) 2014-05-20 US disclosed
US-8623893-B2 Pyridino-pyridinone derivatives, preparation and therapeutic use thereof SANOFI (FR) 2014-01-07 US disclosed
US-20130005724-A1 PYRIDINO-PYRIDINONE DERIVATIVES, PREPARATION AND THERAPEUTIC USE THEREOF SANOFI (FR) 2013-01-03 US disclosed
EP-2524915-A1 2-Amino-3-(imidazol-2-yl)-pyridin-4-one derivatives and their use as VEGF receptor kinase inhibitors SANOFI (FR) 2012-11-21 EP disclosed
EP-2504338-A1 PYRIDINE-PYRIDINONE DERIVATIVES, PREPARATION AND THERAPEUTIC USE THEREOF SANOFI (FR) 2012-10-03 EP disclosed
US-20120181516-A1 LIGHT-ABSORBING MATERIAL AND PHOTOELECTRIC CONVERSION ELEMENT PANASONIC ELECTRIC WORKS CO., LTD. (JP) 2012-07-19 US disclosed
US-20120181516-A1 LIGHT-ABSORBING MATERIAL AND PHOTOELECTRIC CONVERSION ELEMENT PANASONIC ELECTRIC WORKS CO., LTD. (JP) 2012-07-19 US disclosed
EP-2433989-A1 LIGHT-ABSORBING MATERIAL AND PHOTOELECTRIC CONVERSION ELEMENT Panasonic Corporation (JP) 2012-03-28 EP disclosed
WO-2011061458-A1 PYRIDINE-PYRIDINONE DERIVATIVES, PREPARATION AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2011-05-26 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-20130005724-A1 PYRIDINO-PYRIDINONE DERIVATIVES, PREPARATION AND THERAPEUTIC USE THEREOF PDGFRB, FLT3, PDGFRA CYP19A1 1294/4885ALDH1A1 847/4885EGLN3 1954/4885
US-20120181516-A1 LIGHT-ABSORBING MATERIAL AND PHOTOELECTRIC CONVERSION ELEMENT PPOX, CRY1, CYBA CYP19A1 192/4885ALDH1A1 110/4885EGLN3 2298/4885

“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.