SCHEMBL5449252

SCHEMBL5449252

O=C1CC(=O)N(c2ccccn2)N1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CD274 Q9NZQ7 9/20 0.47
PDCD1 Q15116 7/20 0.47
CRBN Q96SW2 1/20 0.47
ALOX5 P09917 1/20 0.47
GAA P10253 2/20 0.44
ALDH1A1 P00352 1/20 0.44
POLB P06746 1/20 0.44
MAPT P10636 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.43
PLD1 Q13393 1/20 0.42
MAPK1 P28482 1/20 0.41
EP300 Q09472 1/20 0.41
KAT2B Q92831 1/20 0.41
CHEK1 O14757 1/20 0.41
AURKA O14965 1/20 0.41
DAPK3 O43293 1/20 0.41
JAK2 O60674 1/20 0.41
PRKD3 O94806 1/20 0.41
MAP4K4 O95819 1/20 0.41
PAK4 O96013 1/20 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
SCHEMBL29048963 0.75 CRBN (0.54) CD274PDCD1CRBNALOX5GAA
SCHEMBL3043229 0.72 GAA (0.64) CRBNALOX5GAAALDH1A1POLB
SCHEMBL6131059 0.69 SMN1; SMN2 (0.56) CD274PDCD1CRBNALOX5GAA
SCHEMBL8805438 0.69 ALDH1A1 (0.47) CD274PDCD1CRBNGAAALDH1A1
SCHEMBL7964509 0.69 CRBN (0.47) CD274PDCD1CRBNALOX5GAA
SCHEMBL19062530 0.69 ALOX5 (0.64) CD274PDCD1CRBNALOX5GAA
SCHEMBL9788869 0.68 SMN1; SMN2 (0.60) CD274PDCD1CRBNALOX5GAA
SCHEMBL10372621 0.68 SMN1; SMN2 (0.55) CD274PDCD1CRBNALOX5GAA
SCHEMBL2340654 0.68 HPGD (0.57) CD274PDCD1GAAALDH1A1POLB
SCHEMBL7604149 0.68 CRBN (0.50) CD274PDCD1CRBNALOX5GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070037846-A1 Pyrazolidinedione derivatives ACTELION PHARMACEUTICALS, LTD. (CH) 2007-02-15 US claimed
US-20070037846-A1 Pyrazolidinedione derivatives ACTELION PHARMACEUTICALS, LTD. (CH) 2007-02-15 US disclosed
WO-2005002574-A1 PYRAZOLIDINEDIONE DERIVATIVES AND THEIR USE AS PLATELET AGGREGATION INHIBITORS ACTELION PHARMACEUTICALS LTD (CH) 2005-01-13 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-20070037846-A1 Pyrazolidinedione derivatives P2RY1, P2RY4, P2RY2 CD274 1230/4885PDCD1 792/4885CRBN 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.