SCHEMBL6564757

SCHEMBL6564757

N[C@H](CC1CCCCC1)C(O)C(=O)NNc1ncc(C(=O)O)c(C(F)(F)F)n1

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ METAP2 P50579 15/20 0.49
▸ METAP1 P53582 7/20 0.49
▸ CYP3A4 P08684 3/20 0.40
▸ CYP2C9 P11712 3/20 0.40
▸ CYP2C19 P33261 3/20 0.40
▸ CNR2 P34972 3/20 0.40
▸ CYP1A2 P05177 2/20 0.39
▸ PDE5A O76074 1/20 0.38
▸ PDE9A O76083 1/20 0.38
▸ CYP2D6 P10635 1/20 0.37
▸ MAPT P10636 1/20 0.37

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
SCHEMBL6487736 0.90 MAPT (0.50) METAP2METAP1CYP3A4CYP2C9CYP2C19
SCHEMBL6476693 0.83 METAP2 (0.46) METAP2METAP1CYP3A4CYP2C9CYP2C19
SCHEMBL6477429 0.72 METAP2 (0.73) METAP2METAP1
SCHEMBL6485528 0.70 METAP2 (0.78) METAP2METAP1
SCHEMBL6476882 0.69 METAP2 (0.60) METAP2METAP1
SCHEMBL6477262 0.69 METAP2 (0.62) METAP2METAP1MAPT
SCHEMBL6484944 0.69 METAP2 (0.54) METAP2METAP1
SCHEMBL6487669 0.69 METAP2 (0.78) METAP2METAP1
SCHEMBL6487790 0.68 METAP2 (0.67) METAP2METAP1
SCHEMBL6477167 0.68 METAP2 (0.62) 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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