SCHEMBL4624772

SCHEMBL4624772

COc1ccc(C[C@@H](N)C=O)cc1OC

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LDHA P00338 1/20 0.57
CA2 P00918 3/20 0.52
KDM4E B2RXH2 2/20 0.50
ATM Q13315 1/20 0.50
ALOX15 P16050 2/20 0.49
ALOX12 P18054 1/20 0.49
ALDH1A1 P00352 3/20 0.49
PPARG P37231 1/20 0.49
PPARD Q03181 1/20 0.49
PPARA Q07869 1/20 0.49
PKM P14618 1/20 0.48
CYP19A1 P11511 1/20 0.47
POLB P06746 1/20 0.45
AOC3 Q16853 1/20 0.45
CA12 O43570 2/20 0.45
CA1 P00915 2/20 0.45
CA9 Q16790 2/20 0.45
CA4 P22748 1/20 0.45
TSHR P16473 1/20 0.44
SMN1; SMN2 Q16637 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
SCHEMBL3388464 1.00 LDHA (0.57) LDHACA2KDM4EATMALOX15
SCHEMBL10412987 0.86 FOS (0.62) ATMALOX15ALOX12ALDH1A1TSHR
SCHEMBL8076708 0.83 LDHA (0.60) LDHACA2KDM4EATMALOX15
SCHEMBL4247499 0.83 LDHA (0.60) LDHACA2KDM4EATMALOX15
SCHEMBL5792794 0.81 LDHA (0.58) LDHACA2KDM4EATMALOX15
SCHEMBL9394901 0.81 HTR2A (0.49) CA2CYP19A1AOC3CA12CA1
SCHEMBL2564908 0.79 LDHA (0.59) LDHACA2KDM4EATMALOX15
SCHEMBL31545634 0.79 LDHA (0.59) LDHACA2KDM4EATMALOX15
SCHEMBL31545527 0.79 LDHA (0.59) LDHACA2KDM4EATMALOX15
SCHEMBL3371646 0.79 LDHA (0.59) LDHACA2KDM4EATMALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1078002-B1 PEPTIDE ANTIANGIOGENIC DRUGS ABBOTT LAB (US) 2008-05-21 EP claimed
US-20050124548-A1 Peptide antiangiogenic drugs HENKIN JACK (US) 2005-06-09 US claimed
US-6753408-B1 DRUGS USED FOR THERAPY ABBVIE INC. 2004-06-22 US claimed
US-6716963-B1 OLIGOPEPTIDES ABBOTT LABORATORIES 2004-04-06 US claimed
EP-1232183-A2 PEPTIDES HAVING ANTIANGIOGENIC ACTIVITY ABBOTT LABORATORIES (US) 2002-08-21 EP claimed
WO-2001038347-A2 PEPTIDES HAVING ANTIANGIOGENIC ACTIVITY ABBOTT LABORATORIES (US) 2001-05-31 WO claimed
EP-1078002-A1 PEPTIDE ANTIANGIOGENIC DRUGS ABBOTT LABORATORIES (US) 2001-02-28 EP claimed
WO-1999061476-A1 PEPTIDE ANTIANGIOGENIC DRUGS ABBOTT LABORATORIES (US) 1999-12-02 WO claimed
EP-1078002-B1 PEPTIDE ANTIANGIOGENIC DRUGS ABBOTT LAB (US) 2008-05-21 EP disclosed
US-20050124548-A1 Peptide antiangiogenic drugs HENKIN JACK (US) 2005-06-09 US disclosed
US-6774211-B1 Peptide antiangiogenic drugs ABBOTT LABORATORIES 2004-08-10 US disclosed
US-6753408-B1 DRUGS USED FOR THERAPY ABBVIE INC. 2004-06-22 US disclosed
US-6716963-B1 OLIGOPEPTIDES ABBOTT LABORATORIES 2004-04-06 US disclosed
EP-1232183-A2 PEPTIDES HAVING ANTIANGIOGENIC ACTIVITY ABBOTT LABORATORIES (US) 2002-08-21 EP disclosed
WO-2001038347-A2 PEPTIDES HAVING ANTIANGIOGENIC ACTIVITY ABBOTT LABORATORIES (US) 2001-05-31 WO disclosed
EP-1078002-A1 PEPTIDE ANTIANGIOGENIC DRUGS ABBOTT LABORATORIES (US) 2001-02-28 EP disclosed
WO-1999061476-A1 PEPTIDE ANTIANGIOGENIC DRUGS ABBOTT LABORATORIES (US) 1999-12-02 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-20050124548-A1 Peptide antiangiogenic drugs VEGFA, NPPA, FLT1 LDHA 1454/4885CA2 2504/4885KDM4E 4413/4885

“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.