SCHEMBL4255663

SCHEMBL4255663

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

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.54
SMN1; SMN2 Q16637 2/20 0.54
LMNA P02545 2/20 0.50
MEN1 O00255 2/20 0.50
HPGD P15428 2/20 0.50
ALDH1A1 P00352 3/20 0.46
KDM4E B2RXH2 3/20 0.46
CYP3A4 P08684 2/20 0.44
HTT P42858 2/20 0.44
CYP1A2 P05177 1/20 0.44
CYP2C19 P33261 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
CYP2C9 P11712 1/20 0.42
PKM P14618 1/20 0.42
PKLR P30613 1/20 0.42
FSCN1 Q16658 1/20 0.41
MAPT P10636 2/20 0.41
GAA P10253 1/20 0.41
HSD17B10 Q99714 1/20 0.41
TP53 P04637 3/20 0.41

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 0.89 ALDH1A1 (0.51) KMT2ASMN1; SMN2LMNAMEN1HPGD
SCHEMBL4256751 0.89 ALDH1A1 (0.47) KMT2ASMN1; SMN2MEN1ALDH1A1KDM4E
SCHEMBL4260164 0.87 CYP19A1 (0.48) KMT2ASMN1; SMN2LMNAMEN1ALDH1A1
SCHEMBL4255683 0.86 PKM (0.47) KMT2ALMNAMEN1ALDH1A1KDM4E
SCHEMBL4255715 0.85 NPBWR1 (0.39) KMT2ASMN1; SMN2LMNAMEN1HPGD
SCHEMBL4253857 0.84 NPBWR1 (0.49) KMT2ASMN1; SMN2LMNAMEN1HPGD
SCHEMBL4252839 0.83 NPBWR1 (0.47) KMT2AMEN1HPGDALDH1A1HTT
SCHEMBL4252764 0.82 ALDH1A1 (0.53) KMT2ASMN1; SMN2LMNAMEN1HPGD
SCHEMBL27751740 0.79 CYP2C19 (0.44) KMT2ASMN1; SMN2LMNAMEN1HPGD
SCHEMBL13619190 0.78 KMT2A (0.39) KMT2ASMN1; SMN2LMNAMEN1HPGD

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 KMT2A 3881/4885SMN1; SMN2 2343/4885LMNA 114/4885

“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.