SCHEMBL6938463

SCHEMBL6938463

CC(C)(C)N(C(=O)O)[C@H](CC1CCCCC1)C(O)C(=O)NN

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.41
KMT2A Q03164 1/20 0.41
METAP2 P50579 4/20 0.38
METAP1 P53582 2/20 0.38
CPB2 Q96IY4 4/20 0.36
CTSK P43235 3/20 0.36
CTSS P25774 1/20 0.36
BCHE P06276 3/20 0.34
LTA4H P09960 1/20 0.33
CTSL P07711 1/20 0.33
CTSB P07858 1/20 0.33
CTSH P09668 1/20 0.33
REN P00797 1/20 0.33
TSHR P16473 1/20 0.33

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
SCHEMBL3666308 0.82 CCR1 (0.37) KMT2AMETAP2METAP1CPB2CTSK
SCHEMBL1859132 0.81 CTSK (0.40) KMT2ACPB2CTSKCTSSBCHE
SCHEMBL969488 0.80 CPB2 (0.36) ALDH1A1METAP2METAP1CPB2CTSK
SCHEMBL1865571 0.80 CTSK (0.40) CTSKCTSSLTA4HCTSLCTSB
SCHEMBL970649 0.77 CTSK (0.36) CPB2CTSKCTSSBCHECTSL
SCHEMBL972385 0.77 CTSK (0.36) CPB2CTSKCTSSBCHECTSL
SCHEMBL6938465 0.76 CTSK (0.43) CPB2CTSKCTSSCTSLCTSB
SCHEMBL7300069 0.73 CTSK (0.33) CTSKCTSSCTSLCTSBCTSH
SCHEMBL6477996 0.71 METAP2 (0.59) ALDH1A1KMT2AMETAP2METAP1REN
SCHEMBL6477560 0.71 METAP2 (0.59) ALDH1A1KMT2AMETAP2METAP1REN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1272456-A1 HYDRAZIDE AND ALKOXYAMIDE ANGIOGENESIS INHIBITORS Abbott Laboratories (US) 2003-01-08 EP disclosed
WO-2001079157-A1 HYDRAZIDE AND ALKOXYAMIDE ANGIOGENESIS INHIBITORS ABBOTT LABORATORIES (US) 2001-10-25 WO disclosed