SCHEMBL2839593

SCHEMBL2839593

COC(=O)CCC(=O)Nc1ccc(C(=O)NNC(=O)OC(C)(C)C)cc1

nearest known ligand 0.60

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.57
MEN1 O00255 3/20 0.56
KMT2A Q03164 3/20 0.56
L3MBTL1 Q9Y468 2/20 0.56
CYP1A2 P05177 1/20 0.56
ATM Q13315 1/20 0.56
GAA P10253 1/20 0.54
HTT P42858 2/20 0.53
ALDH1A1 P00352 2/20 0.53
MAPT P10636 3/20 0.49
SMN1; SMN2 Q16637 2/20 0.48
RAB9A P51151 1/20 0.48
CTSL P07711 1/20 0.46
PTPRC P08575 1/20 0.46
PTPN13 Q12923 1/20 0.46
LMNA P02545 2/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44

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
SCHEMBL2835013 0.93 HDAC8 (0.50) HPGDMEN1KMT2AL3MBTL1CYP1A2
SCHEMBL2835595 0.92 HDAC8 (0.52) HPGDMEN1KMT2AL3MBTL1CYP1A2
SCHEMBL2833329 0.83 GAA (0.64) HPGDMEN1KMT2AL3MBTL1CYP1A2
SCHEMBL17202869 0.83 NAMPT (0.53) MEN1KMT2AGAAALDH1A1MAPT
SCHEMBL2834391 0.79 NPC1 (0.58) HPGDMEN1KMT2AL3MBTL1ATM
SCHEMBL31415849 0.78 L3MBTL1 (0.55) HPGDMEN1KMT2AL3MBTL1GAA
SCHEMBL2659302 0.77 CD274 (0.56) ALDH1A1MAPTSMN1; SMN2LMNA
SCHEMBL15684322 0.76 APLNR (0.51) HPGDMEN1KMT2AL3MBTL1CYP1A2
SCHEMBL13167729 0.76 MAPT (0.42) HPGDMEN1KMT2AGAAHTT
SCHEMBL2836609 0.75 TDP1 (0.56) HPGDMEN1KMT2AL3MBTL1CYP1A2

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 5 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 disclosed
US-7696231-B2 Oxindole hydrazide modulators of protein tyrosine phosphatases (PTPs) LABORATOIRES SERONO SA (CH) 2010-04-13 US disclosed
US-20050043388-A1 Oxindole hydrazide modulators of protein tyrosine phosphatases (ptps) APPLIED RESEARCH SYSTEMS ARS HOLDING N.V. 2005-02-24 US disclosed
EP-1439834-A1 OXINDOLE HYDRAZIDE MODULATORS OF PROTEIN TYROSINE PHOSPHATASES (PTPS) Applied Research Systems ARS Holding N.V. (AN) 2004-07-28 EP disclosed
WO-2003037328-A1 OXINDOLE HYDRAZIDE MODULATORS OF PROTEIN TYROSINE PHOSPHATASES (PTPS) APPLIED RESEARCH SYSTEMS ARS HOLDING N.V. (NL) 2003-05-08 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 (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 HPGD 1951/4885MEN1 4402/4885KMT2A 3816/4885
US-20100168101-A1 OXINDOLE HYDRAZIDE MODULATORS OF PROTEIN TYROSINE PHOSPHATASES (PTPS) PTPRO, PTPRE, PTPRZ1 HPGD 1990/4885MEN1 4405/4885KMT2A 3784/4885

“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.