SCHEMBL6942789

SCHEMBL6942789

CCSCC[C@@H](N)[C@@H](O)C(=O)NNC(=O)c1cccc(OC)c1

nearest known ligand 0.76

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
METAP2 P50579 16/20 0.76
METAP1 P53582 10/20 0.76
NPC1 O15118 2/20 0.51
RAB9A P51151 2/20 0.51
TAS1R3 Q7RTX0 1/20 0.48
TAS1R1 Q7RTX1 1/20 0.48
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47

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
SCHEMBL6487005 1.00 METAP2 (0.76) METAP2METAP1NPC1RAB9ATAS1R3
SCHEMBL6477810 0.89 METAP2 (0.67) METAP2METAP1
SCHEMBL6486408 0.88 METAP2 (0.70) METAP2METAP1
SCHEMBL6478050 0.88 METAP2 (0.74) METAP2METAP1NPC1RAB9ATAS1R3
SCHEMBL6477162 0.87 METAP2 (0.82) METAP2METAP1
SCHEMBL6477809 0.87 METAP2 (0.75) METAP2METAP1
SCHEMBL6476117 0.87 METAP2 (0.82) METAP2METAP1
SCHEMBL6477373 0.86 METAP2 (1.00) METAP2METAP1
SCHEMBL6484860 0.86 METAP2 (1.00) METAP2METAP1
SCHEMBL6490543 0.86 METAP2 (0.80) METAP2METAP1MEN1KMT2A

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