SCHEMBL7364506

SCHEMBL7364506

O=C(O)C(Cc1ccc(P(=O)(O)O)cc1)NCO

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 2/20 0.43
MME P08473 5/20 0.41
ECE1 P42892 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.38
ACE P12821 2/20 0.38
CPA1 P15085 1/20 0.38
ACE2 Q9BYF1 1/20 0.38

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
SCHEMBL7367519 0.86 MME (0.46) PTPN1MMEECE1MEN1KMT2A
SCHEMBL7364721 0.83 PTPN1 (0.43) PTPN1MMEL3MBTL1ACECPA1
SCHEMBL852956 0.83 PTPN1 (0.43) PTPN1MMEL3MBTL1ACECPA1
SCHEMBL18129829 0.83 PTPN1 (0.43) PTPN1MMEL3MBTL1ACECPA1
SCHEMBL2214359 0.80 FOLH1 (0.55) MMEMEN1KMT2AL3MBTL1ACE
SCHEMBL10778599 0.80 FOLH1 (0.55) MMEMEN1KMT2AL3MBTL1ACE
SCHEMBL2214358 0.80 FOLH1 (0.55) MMEMEN1KMT2AL3MBTL1ACE
SCHEMBL3705739 0.80 MME (0.43) PTPN1MMEECE1L3MBTL1
SCHEMBL27947361 0.80 PTPN1 (0.42) PTPN1MMEMEN1KMT2AL3MBTL1
SCHEMBL9545901 0.80 MME (0.43) PTPN1MMEECE1L3MBTL1

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-6307090-B1 OXALYL ENDCAPPED; CONTAINING A BIVALENT RADICAL OF PHOSPHOTYROSINE OR A PHOSPHOTYROSINE MIMETIC THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES 2001-10-23 US claimed
US-6307090-B1 OXALYL ENDCAPPED; CONTAINING A BIVALENT RADICAL OF PHOSPHOTYROSINE OR A PHOSPHOTYROSINE MIMETIC THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES 2001-10-23 US disclosed
EP-0846127-A1 ACYLATED OLIGOPEPTIDE DERIVATIVES HAVING CELL SIGNAL INHIBITING ACTIVITY Novartis AG (CH) 1998-06-10 EP disclosed
WO-1997008193-A1 ACYLATED OLIGOPEPTIDE DERIVATIVES HAVING CELL SIGNAL INHIBITING ACTIVITY NOVARTIS AG (CH) 1997-03-06 WO disclosed
WO-1997007131-A1 ACYLATED OLIGOPEPTIDES CONTAINING PHOSPHOTYROSINE AS INHIBITORS OF PROTEIN TYROSINE KINASES NOVARTIS AG (CH) 1997-02-27 WO disclosed