SCHEMBL6561605

SCHEMBL6561605

N[C@H](CC1CCCCC1)C(O)C(=O)N(N)C(=O)c1cc(Cl)ccc1Cl

nearest known ligand 0.64

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
METAP2 P50579 14/20 0.64
METAP1 P53582 8/20 0.53
PYGL P06737 1/20 0.39
SLC6A2 P23975 1/20 0.39
SLC6A4 P31645 1/20 0.39
SLC6A3 Q01959 1/20 0.39
KCNH2 Q12809 1/20 0.39
TAS1R3 Q7RTX0 1/20 0.37
TAS1R1 Q7RTX1 1/20 0.37
TAS1R2 Q8TE23 1/20 0.37
ALDH1A1 P00352 1/20 0.36
TSHR P16473 1/20 0.36
DPEP1 P16444 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
SCHEMBL6564663 0.87 METAP2 (0.50) METAP2METAP1SLC6A2SLC6A4SLC6A3
SCHEMBL6564599 0.83 METAP2 (0.64) METAP2METAP1SLC6A2SLC6A4SLC6A3
SCHEMBL6938260 0.79 PDK1 (0.45) METAP2METAP1ALDH1A1
SCHEMBL6477882 0.78 METAP2 (1.00) METAP2METAP1TAS1R3TAS1R1TAS1R2
SCHEMBL6938170 0.78 METAP2 (0.49) METAP2METAP1
SCHEMBL6564589 0.78 METAP2 (0.49) METAP2METAP1
SCHEMBL6935836 0.75 METAP2 (0.46) METAP2METAP1DPEP1
SCHEMBL6938795 0.74 METAP2 (0.64) METAP2METAP1SLC6A2SLC6A4SLC6A3
SCHEMBL7360094 0.74 METAP2 (0.60) METAP2METAP1PYGLSLC6A2SLC6A4
SCHEMBL6939040 0.72 METAP2 (0.46) METAP2METAP1ALDH1A1

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 3 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
EP-1272456-B1 HYDRAZIDE AND ALKOXYAMIDE ANGIOGENESIS INHIBITORS ABBOTT LAB (US) 2004-10-27 EP disclosed