SCHEMBL7072345

SCHEMBL7072345

CC(C)SCC[C@@H](N)C(O)C(=O)c1nc(C(=O)NN)cs1

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
METAP2 P50579 13/20 0.44
METAP1 P53582 11/20 0.44
MAPT P10636 2/20 0.32
ALDH1A1 P00352 2/20 0.32
HTT P42858 1/20 0.32
NPSR1 Q6W5P4 2/20 0.32
KDM4E B2RXH2 1/20 0.32
LMNA P02545 1/20 0.32

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
SCHEMBL7074810 0.86 METAP2 (0.45) METAP2METAP1MAPTALDH1A1HTT
SCHEMBL6941278 0.67 METAP2 (0.48) METAP2METAP1MAPTALDH1A1
SCHEMBL6477922 0.67 METAP2 (0.54) METAP2METAP1ALDH1A1HTTKDM4E
SCHEMBL6486999 0.67 METAP2 (0.54) METAP2METAP1ALDH1A1
SCHEMBL6477252 0.66 METAP2 (0.66) METAP2METAP1
SCHEMBL16160989 0.65 METAP2 (0.54) METAP2METAP1
SCHEMBL5848309 0.65 METAP2 (0.56) METAP2METAP1
SCHEMBL5849991 0.65 METAP2 (0.56) METAP2METAP1
SCHEMBL6245482 0.65 METAP2 (0.56) METAP2METAP1
SCHEMBL14844994 0.64 TLR7 (0.58) MAPTALDH1A1HTTNPSR1KDM4E

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 claimed
WO-2001079157-A1 HYDRAZIDE AND ALKOXYAMIDE ANGIOGENESIS INHIBITORS ABBOTT LABORATORIES (US) 2001-10-25 WO claimed