SCHEMBL22010993

SCHEMBL22010993

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nearest known ligand 0.60

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CASP3 P42574 19/20 0.60
NR4A1 P22736 1/20 0.59
HSP90AB1 P08238 1/20 0.58
CDC37 Q16543 1/20 0.58

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
SCHEMBL22010604 0.92 NR4A1 (0.69) CASP3NR4A1HSP90AB1CDC37
SCHEMBL22010869 0.91 NR4A1 (0.62) CASP3NR4A1HSP90AB1CDC37
SCHEMBL22010975 0.90 NR4A1 (0.61) CASP3NR4A1HSP90AB1CDC37
SCHEMBL18782169 0.90 CASP3 (0.73) CASP3NR4A1HSP90AB1CDC37
SCHEMBL26210798 0.90 CASP3 (0.73) CASP3NR4A1HSP90AB1CDC37
SCHEMBL22010858 0.90 NR4A1 (0.66) CASP3NR4A1HSP90AB1CDC37
SCHEMBL23054483 0.89 NR4A1 (0.62) CASP3NR4A1HSP90AB1CDC37
SCHEMBL22010887 0.89 NR4A1 (0.58) CASP3NR4A1HSP90AB1CDC37
SCHEMBL22010608 0.89 NR4A1 (0.69) CASP3NR4A1
SCHEMBL22011117 0.89 NR4A1 (0.58) CASP3NR4A1HSP90AB1CDC37

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-10662218-B2 Analogs of celastrol ERX PHARMACEUTICALS CORPORATION 2020-05-26 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-10662218-B2 Analogs of celastrol GIPR, GPR119, EBP CASP3 247/4885NR4A1 1945/4885HSP90AB1 191/4885

“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.