SCHEMBL6563107

SCHEMBL6563107

N[C@H](CC1CCCCC1)C(O)C(=O)NNc1ccsc1C(=O)O

nearest known ligand 0.60

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ METAP2 P50579 19/20 0.60
▸ METAP1 P53582 9/20 0.60
▸ ALDH1A1 P00352 1/20 0.38
▸ CASP3 P42574 1/20 0.38
▸ SENP7 Q9BQF6 1/20 0.38
▸ SENP6 Q9GZR1 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38

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
SCHEMBL6932813 0.89 METAP2 (0.58) METAP2METAP1ALDH1A1CASP3SENP7
SCHEMBL6487629 0.89 METAP2 (0.58) METAP2METAP1ALDH1A1CASP3SENP7
SCHEMBL6561675 0.79 METAP2 (0.59) METAP2METAP1
SCHEMBL6485528 0.78 METAP2 (0.78) METAP2METAP1
SCHEMBL6487742 0.76 METAP2 (0.72) METAP2METAP1
SCHEMBL6477759 0.76 METAP2 (0.72) METAP2METAP1
SCHEMBL6477713 0.76 METAP2 (0.72) METAP2METAP1
SCHEMBL6476546 0.76 METAP2 (0.71) METAP2METAP1
SCHEMBL6488946 0.75 METAP2 (1.00) METAP2METAP1
SCHEMBL6478669 0.75 METAP2 (0.61) METAP2METAP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1272456-B1 HYDRAZIDE AND ALKOXYAMIDE ANGIOGENESIS INHIBITORS ABBOTT LAB (US) 2004-10-27 — — EP claimed
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