SCHEMBL962281

SCHEMBL962281

O=C(O)C(Cc1ccccc1)N(CF)P(=O)(O)O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LAP3 P28838 6/20 0.47
ANPEP P15144 3/20 0.47
CYP1A2 P05177 1/20 0.44
ACP3 P15309 1/20 0.42
ALPI P09923 1/20 0.42
PKM P14618 1/20 0.42
PTGS1 P23219 1/20 0.42
XIAP P98170 1/20 0.42
SLC7A5 Q01650 1/20 0.42
ERAP2 Q6P179 2/20 0.40
CPA1 P15085 2/20 0.40
CPA3 P15088 2/20 0.40
FOLH1 Q04609 1/20 0.40
CPB1 P15086 1/20 0.40
CPB2 Q96IY4 1/20 0.40
SRR Q9GZT4 1/20 0.39
SLC1A3 P43003 1/20 0.39
SLC1A2 P43004 1/20 0.39
SLC1A1 P43005 1/20 0.39
ERAP1 Q9NZ08 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
SCHEMBL9715668 1.00 LAP3 (0.47) LAP3ANPEPCYP1A2ACP3ALPI
SCHEMBL9715671 0.86 CYP1A2 (0.46) LAP3ANPEPCYP1A2ACP3ALPI
SCHEMBL958771 0.86 CYP1A2 (0.46) LAP3ANPEPCYP1A2ACP3ALPI
SCHEMBL9715674 0.84 CYP1A2 (0.44) LAP3ANPEPCYP1A2ACP3ALPI
SCHEMBL9715672 0.84 CYP1A2 (0.44) LAP3ANPEPCYP1A2ACP3ALPI
SCHEMBL9715663 0.84 CYP1A2 (0.44) LAP3ANPEPCYP1A2ACP3ALPI
SCHEMBL9715664 0.84 CYP1A2 (0.44) LAP3ANPEPCYP1A2ACP3ALPI
SCHEMBL14637889 0.80 CYP1A2 (0.50) LAP3ANPEPCYP1A2ACP3ALPI
SCHEMBL14637890 0.80 CYP1A2 (0.50) LAP3ANPEPCYP1A2ACP3ALPI
SCHEMBL1486794 0.80 ANPEP (0.48) LAP3ANPEPCYP1A2SLC7A5ERAP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7871981-B2 Inhibition of cell motility, angiogenesis, and metastasis THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2011-01-18 US claimed
US-7132392-B1 Inhibition of cell motility and angiogenesis by inhibitors of Grb2-SH2-domain THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2006-11-07 US claimed
EP-1223959-A2 INHBITION OF CELL MOTILITY AND ANGIOGENESIS BY INHIBITORS OF THE GRB2 SH2-DOMAIN THE GOVERNMENT OF THE UNITED STATES OF AMERICA, as represented by THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2002-07-24 EP 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 claimed
WO-2001028577-A2 INHIBITION OF CELL MOTILITY AND ANGIOGENESIS BY INHIBITORS OF THE GRB2 SH2-DOMAIN THE GOVERNMENT OF THE UNITED STATES OF AMERICA, REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2001-04-26 WO claimed
EP-0846127-A1 ACYLATED OLIGOPEPTIDE DERIVATIVES HAVING CELL SIGNAL INHIBITING ACTIVITY Novartis AG (CH) 1998-06-10 EP claimed
WO-1997008193-A1 ACYLATED OLIGOPEPTIDE DERIVATIVES HAVING CELL SIGNAL INHIBITING ACTIVITY NOVARTIS AG (CH) 1997-03-06 WO claimed
WO-1994007913-A1 PEPTIDE ANTAGONISTS OF SH2 BINDING AND THERAPEUTIC USES THEREOF WARNER-LAMBERT COMPANY (US) 1994-04-14 WO claimed
US-7871981-B2 Inhibition of cell motility, angiogenesis, and metastasis THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2011-01-18 US disclosed
WO-2008036565-A1 TRIPEPTIDES FOR TREATING CANCER METASTASIS, PROSTATE CANCER AND MELANOMA GOVERNMENT OF THE UNITED STATES, REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2008-03-27 WO disclosed
EP-1223959-B1 INHIBITION OF CELL MOTILITY AND ANGIOGENESIS BY INHIBITORS OF THE GRB2 SH2-DOMAIN US GOV HEALTH & HUMAN SERV (US) 2007-05-23 EP disclosed
US-20070042966-A1 Inhibition of cell motility, angiogenesis, and metastasis Gov't of the USA, represented by the Secretary, Dep't of Health and Human Services (US) 2007-02-22 US disclosed
US-7132392-B1 Inhibition of cell motility and angiogenesis by inhibitors of Grb2-SH2-domain THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2006-11-07 US disclosed
EP-1223959-A2 INHBITION OF CELL MOTILITY AND ANGIOGENESIS BY INHIBITORS OF THE GRB2 SH2-DOMAIN THE GOVERNMENT OF THE UNITED STATES OF AMERICA, as represented by THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2002-07-24 EP disclosed
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
WO-2001028577-A2 INHIBITION OF CELL MOTILITY AND ANGIOGENESIS BY INHIBITORS OF THE GRB2 SH2-DOMAIN THE GOVERNMENT OF THE UNITED STATES OF AMERICA, REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2001-04-26 WO 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
WO-1994007913-A1 PEPTIDE ANTAGONISTS OF SH2 BINDING AND THERAPEUTIC USES THEREOF WARNER-LAMBERT COMPANY (US) 1994-04-14 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 (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-20070042966-A1 Inhibition of cell motility, angiogenesis, and metastasis HGF, HDGF, MET LAP3 478/4885ANPEP 366/4885CYP1A2 4880/4885

“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.