SCHEMBL10054152

SCHEMBL10054152

COc1cc(N=O)cc(C(N)=O)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PARP1 P09874 2/20 0.51
▸ PARP10 Q53GL7 2/20 0.48
▸ CA1 P00915 1/20 0.48
▸ CA2 P00918 1/20 0.48
▸ PARP2 Q9UGN5 1/20 0.48
▸ PARP4 Q9UKK3 1/20 0.48
▸ PLAU P00749 1/20 0.44
▸ KDM4E B2RXH2 2/20 0.40
▸ TSHR P16473 1/20 0.40
▸ APOBEC3A P31941 1/20 0.40
▸ HTT P42858 1/20 0.40
▸ APOBEC3G Q9HC16 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ POLB P06746 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ MKNK1 Q9BUB5 1/20 0.40
▸ MKNK2 Q9HBH9 1/20 0.40
▸ MAP4K4 O95819 1/20 0.40
▸ HPGDS O60760 1/20 0.39
▸ HTR3E A5X5Y0 1/20 0.39

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
SCHEMBL5225799 0.82 PARP1 (0.64) PARP1PARP10CA1CA2PARP2
SCHEMBL894796 0.82 PARP1 (0.64) PARP1PARP10CA1CA2PARP2
SCHEMBL11957888 0.78 ALDH1A1 (0.58) KDM4EHTTMAPTPOLBKMT2A
SCHEMBL19828394 0.76 PARP1 (0.56) PARP1PARP10CA1CA2PARP2
SCHEMBL14192803 0.76 PARP1 (0.56) PARP1PARP10CA1CA2PARP2
SCHEMBL3087859 0.76 PARP1 (0.56) PARP1PARP10CA1CA2PARP2
SCHEMBL23360890 0.74 PARP1 (0.55) PARP1PARP10CA1CA2PARP2
SCHEMBL1362735 0.74 PARP1 (0.55) PARP1PARP10CA1CA2PARP2
SCHEMBL6171991 0.74 PARP1 (0.59) PARP1PARP10CA1CA2PARP2
SCHEMBL29826907 0.74 PARP1 (0.55) PARP1PARP10CA1CA2PARP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120053208-A1 Curcumin Analogs as Dual JAK2/STAT3 Inhibitors and Methods of Making and Using the Same THE OHIO STATE UNIVERSITY RESEARCH FOUNDATION (US) 2012-03-01 — — US 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-20120053208-A1 Curcumin Analogs as Dual JAK2/STAT3 Inhibitors and Methods of Making and Using the Same JAK2, STAT3, STAT5B PARP1 1850/4885PARP10 1401/4885CA1 3074/4885

“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.

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