SCHEMBL4255683

SCHEMBL4255683

CCOC(=O)C(CC)c1ccnn(Cc2cccc(OC)c2)c1=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 3/20 0.47
ALDH1A1 P00352 2/20 0.47
GAA P10253 1/20 0.47
MAPT P10636 2/20 0.46
KDM4E B2RXH2 1/20 0.46
NPBWR1 P48145 1/20 0.44
CMA1 P23946 1/20 0.44
FPR1 P21462 1/20 0.43
FPR3 P25089 1/20 0.43
FPR2 P25090 1/20 0.43
AURKA O14965 2/20 0.43
GRK2 P25098 1/20 0.43
ROCK1 Q13464 1/20 0.43
RPS6KA1 Q15418 1/20 0.43
CD74 P04233 1/20 0.43
MIF P14174 1/20 0.43
HCAR3 P49019 1/20 0.42
LMNA P02545 1/20 0.42
TP53 P04637 1/20 0.42
ROCK2 O75116 1/20 0.42

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
SCHEMBL4257569 0.88 ALDH1A1 (0.51) ALDH1A1MAPTKDM4ENPBWR1LMNA
SCHEMBL4260164 0.86 CYP19A1 (0.48) ALDH1A1MAPTLMNAMEN1KMT2A
SCHEMBL4256751 0.85 ALDH1A1 (0.47) ALDH1A1KDM4ENPBWR1MEN1KMT2A
SCHEMBL4255715 0.84 NPBWR1 (0.39) ALDH1A1KDM4ENPBWR1LMNAMEN1
SCHEMBL4252839 0.84 NPBWR1 (0.47) ALDH1A1GAAMAPTNPBWR1HSD17B10
SCHEMBL4253857 0.83 NPBWR1 (0.49) ALDH1A1MAPTKDM4ENPBWR1LMNA
SCHEMBL4451133 0.78 PKM (0.42) PKMALDH1A1GAAMAPTKDM4E
SCHEMBL4257238 0.77 PKM (0.41) PKMALDH1A1GAAMAPTFPR1
SCHEMBL13608163 0.77 PKM (0.41) PKMALDH1A1GAAMAPTFPR1
SCHEMBL4447381 0.77 PKM (0.37) PKMALDH1A1GAAKDM4ENPBWR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8481537-B2 Caspase inhibitors based of pyridazinone scaffold LG LIFE SCIENCES LTD. (KR) 2013-07-09 US disclosed
US-20090291959-A1 CASPASE INHIBITORS BASED OF PYRIDAZINONE SCAFFOLD LG LIFE SCIENCES LTD. (KR) 2009-11-26 US disclosed
EP-2046757-A1 CASPASE INHIBITORS BASED ON PYRIDAZINONE SCAFFOLD LG Life Sciences Ltd. (KR) 2009-04-15 EP disclosed
WO-2008016239-A1 CASPASE INHIBITORS BASED ON PYRIDAZINONE SCAFFOLD LG LIFE SCIENCES LTD. (KR) 2008-02-07 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-20090291959-A1 CASPASE INHIBITORS BASED OF PYRIDAZINONE SCAFFOLD CASP1, CASP2, CASP5 PKM 1333/4885ALDH1A1 3705/4885GAA 1409/4885

“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.