SCHEMBL3182724

SCHEMBL3182724

COC(=O)C(c1cccn(Cc2ccccc2)c1=O)C(C)C

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 2/20 0.51
BRD2 P25440 1/20 0.51
BRD3 Q15059 1/20 0.51
BRDT Q58F21 1/20 0.51
MAPT P10636 5/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
RAB9A P51151 1/20 0.47
KDM4E B2RXH2 6/20 0.46
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
RECQL P46063 1/20 0.46
ALDH1A1 P00352 3/20 0.45
POLB P06746 3/20 0.45
LMNA P02545 1/20 0.45
PTGER3 P43115 1/20 0.45
IL1RN P18510 1/20 0.43
ERAP2 Q6P179 1/20 0.43
ERAP1 Q9NZ08 1/20 0.43
CNR1 P21554 3/20 0.43
CNR2 P34972 3/20 0.43

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
SCHEMBL3175796 0.84 BRD4 (0.53) BRD4BRD2BRD3BRDTMAPT
SCHEMBL3177116 0.81 BRD4 (0.51) BRD4BRD2BRD3BRDTMAPT
SCHEMBL8208981 0.77 BRD4 (0.43) BRD4BRD2BRD3BRDTMAPT
SCHEMBL3172374 0.75 CASP3 (0.49) BRD4BRD2BRD3BRDTMAPT
SCHEMBL1137191 0.73 BRD4 (0.70) BRD4BRD2BRD3BRDTMAPT
SCHEMBL12376651 0.73 BRD4 (0.73) BRD4BRD2BRD3BRDTMAPT
SCHEMBL3181686 0.71 BRD4 (0.56) BRD4BRD2BRD3BRDTMAPT
SCHEMBL10965858 0.70 BRD4 (0.50) BRD4BRD2BRD3BRDTMAPT
SCHEMBL14324139 0.69 LMNA (0.57) BRD4BRD2BRD3BRDTMAPT
SCHEMBL4983592 0.69 BRD4 (0.67) BRD4BRD2BRD3BRDTMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100016376-A1 CASPASE INHIBITORS BASED ON PYRIDONE SCAFFOLD LG LIFE SCIENCES LTD. (KR) 2010-01-21 US disclosed
CN-101558041-A Caspase inhibitors based on pyridone scaffold LG LIFE SCIENCES LTD (KR) 2009-10-14 CN 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-20100016376-A1 CASPASE INHIBITORS BASED ON PYRIDONE SCAFFOLD CASP1, CASP5, CASP2 BRD4 537/4885BRD2 853/4885BRD3 825/4885

“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.