SCHEMBL6480048

SCHEMBL6480048

CC(C)(C)OC(=O)N[C@@H](CSCC1CCCCC1)C(O)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CTSS P25774 2/20 0.46
CTSK P43235 2/20 0.46
METAP2 P50579 4/20 0.43
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA7 P43166 1/20 0.38
REN P00797 5/20 0.38
CYP3A4 P08684 1/20 0.37
KMT2A Q03164 1/20 0.37
HDAC4 P56524 1/20 0.37
HDAC1 Q13547 1/20 0.37
HDAC6 Q9UBN7 1/20 0.37
EPHX1 P07099 1/20 0.36
METAP1 P53582 1/20 0.36
PPARG P37231 2/20 0.36
PPARA Q07869 2/20 0.36
CACNA1B Q00975 1/20 0.36

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
SCHEMBL6477556 0.84 CTSS (0.54) CTSSCTSKMETAP2KMT2AHDAC4
SCHEMBL4845165 0.84 CTSS (0.54) CTSSCTSKMETAP2KMT2AHDAC4
SCHEMBL6476886 0.84 CTSS (0.54) CTSSCTSKMETAP2KMT2AHDAC4
SCHEMBL7311968 0.84 CTSS (0.56) CTSSCTSKCA1CA2CA7
SCHEMBL9819695 0.84 CTSS (0.56) CTSSCTSKCA1CA2CA7
SCHEMBL7401954 0.84 CTSS (0.56) CTSSCTSKCA1CA2CA7
SCHEMBL13134807 0.84 CTSS (0.56) CTSSCTSKCA1CA2CA7
SCHEMBL5847958 0.84 CTSS (0.56) CTSSCTSKCA1CA2CA7
SCHEMBL7872157 0.84 CTSS (0.56) CTSSCTSKCA1CA2CA7
SCHEMBL7440885 0.83 CTSS (0.48) CTSSCTSKMETAP2RENCYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6887863-B2 Hydrazide and alkoxyamide angiogenesis inhibitors ABBOTT LABORATORIES (US) 2005-05-03 US disclosed
EP-1272456-B1 HYDRAZIDE AND ALKOXYAMIDE ANGIOGENESIS INHIBITORS ABBOTT LAB (US) 2004-10-27 EP disclosed
US-20040167126-A1 Hydrazide and alkoxyamide angiogenesis inhibitors ABBVIE INC. 2004-08-26 US disclosed
EP-1272456-A1 HYDRAZIDE AND ALKOXYAMIDE ANGIOGENESIS INHIBITORS Abbott Laboratories (US) 2003-01-08 EP disclosed
US-20020002152-A1 Hydrazide and alkoxyamide angiogenesis inhibitors ABBOTT LABORATORIES 2002-01-03 US disclosed
WO-2001079157-A1 HYDRAZIDE AND ALKOXYAMIDE ANGIOGENESIS INHIBITORS ABBOTT LABORATORIES (US) 2001-10-25 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-20040167126-A1 Hydrazide and alkoxyamide angiogenesis inhibitors METAP2, METAP1, ANPEP CTSS 1777/4885CTSK 2334/4885METAP2 1/4885
US-20020002152-A1 Hydrazide and alkoxyamide angiogenesis inhibitors METAP2, METAP1, ANPEP CTSS 1777/4885CTSK 2334/4885METAP2 1/4885

“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.