SCHEMBL2833423

SCHEMBL2833423

CC(CCN1C(=O)C(=O)c2cc(I)ccc21)C(=O)O

nearest known ligand 0.60

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CASP3 P42574 1/20 0.51
PARK7 Q99497 4/20 0.43
CTRC Q99895 1/20 0.43
ALDH1A1 P00352 2/20 0.43
CUL4A Q13619 1/20 0.41
LMNA P02545 1/20 0.40
MAPT P10636 1/20 0.40

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
SCHEMBL5114613 0.78 CASP3 (0.63) CASP3PARK7CTRCALDH1A1LMNA
SCHEMBL3525847 0.76 CASP3 (0.53) CASP3PARK7CTRCALDH1A1CUL4A
SCHEMBL18955251 0.74 ALDH1A1 (0.75) CASP3CTRCALDH1A1CUL4AMAPT
SCHEMBL3027498 0.74 ALDH1A1 (0.64) CASP3PARK7CTRCALDH1A1LMNA
SCHEMBL2833377 0.74 CASP3 (0.54) CASP3CTRCALDH1A1LMNA
SCHEMBL2831711 0.73 CASP3 (0.50) CASP3PARK7CTRCALDH1A1LMNA
SCHEMBL18955128 0.73 ALDH1A1 (0.58) CASP3PARK7CTRCALDH1A1LMNA
SCHEMBL5119168 0.73 CES1 (0.65) CASP3CTRCALDH1A1MAPT
SCHEMBL5124354 0.73 CES1 (0.65) CASP3CTRCALDH1A1MAPT
SCHEMBL2833426 0.72 CASP3 (0.48) CASP3CTRCALDH1A1MAPT

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-20100168101-A1 OXINDOLE HYDRAZIDE MODULATORS OF PROTEIN TYROSINE PHOSPHATASES (PTPS) APPLIED RESEARCH SYSTEMS ARS HOLDING N.V. (NL) 2010-07-01 US claimed
US-20050043388-A1 Oxindole hydrazide modulators of protein tyrosine phosphatases (ptps) APPLIED RESEARCH SYSTEMS ARS HOLDING N.V. 2005-02-24 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 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-20050043388-A1 Oxindole hydrazide modulators of protein tyrosine phosphatases (ptps) PTPRO, PTPRE, PTPRZ1 CASP3 4494/4885PARK7 2430/4885CTRC 4670/4885
US-20100168101-A1 OXINDOLE HYDRAZIDE MODULATORS OF PROTEIN TYROSINE PHOSPHATASES (PTPS) PTPRO, PTPRE, PTPRZ1 CASP3 4475/4885PARK7 2437/4885CTRC 4668/4885

“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.