SCHEMBL6477320

SCHEMBL6477320

CC(C)(C)OC(=O)N[C@H](CCC1CCCCC1)[C@H](O)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CTSK P43235 3/20 0.49
CTSS P25774 2/20 0.49
HDAC4 P56524 1/20 0.42
HDAC1 Q13547 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA7 P43166 1/20 0.41
METAP2 P50579 1/20 0.41
KMT2A Q03164 2/20 0.40
REN P00797 6/20 0.40
EPHX1 P07099 1/20 0.39
GAA P10253 2/20 0.38
MEN1 O00255 1/20 0.38
CTSL P07711 1/20 0.37
CTSB P07858 1/20 0.37
HTRA1 Q92743 1/20 0.37
KLK5 Q9Y337 1/20 0.37
CACNA1B Q00975 1/20 0.37

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
SCHEMBL7319821 1.00 CTSK (0.49) CTSKCTSSHDAC4HDAC1HDAC6
SCHEMBL8279730 0.96 CTSK (0.44) CTSKCTSSHDAC4HDAC1HDAC6
SCHEMBL9819695 0.88 CTSS (0.56) CTSKCTSSHDAC4HDAC1HDAC6
SCHEMBL5847958 0.88 CTSS (0.56) CTSKCTSSHDAC4HDAC1HDAC6
SCHEMBL7311968 0.88 CTSS (0.56) CTSKCTSSHDAC4HDAC1HDAC6
SCHEMBL13134807 0.88 CTSS (0.56) CTSKCTSSHDAC4HDAC1HDAC6
SCHEMBL7401954 0.88 CTSS (0.56) CTSKCTSSHDAC4HDAC1HDAC6
SCHEMBL7872157 0.88 CTSS (0.56) CTSKCTSSHDAC4HDAC1HDAC6
SCHEMBL3717189 0.86 CTSK (0.48) CTSKCTSSHDAC4HDAC1HDAC6
SCHEMBL3762677 0.86 CTSK (0.48) CTSKCTSSHDAC4HDAC1HDAC6

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-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
US-20020002152-A1 Hydrazide and alkoxyamide angiogenesis inhibitors ABBOTT LABORATORIES 2002-01-03 US disclosed
WO-2001036404-A1 COMPOUNDS AND METHODS SMITHKLINE BEECHAM CORPORATION (US) 2001-05-25 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 CTSK 2334/4885CTSS 1777/4885HDAC4 1532/4885
US-20020002152-A1 Hydrazide and alkoxyamide angiogenesis inhibitors METAP2, METAP1, ANPEP CTSK 2334/4885CTSS 1777/4885HDAC4 1532/4885

“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.