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Sugi Predict / Compounds / SCHEMBL3862348

SCHEMBL3862348

SCHEMBL3862348

C#CCC(CP(=O)(O)C(Cc1ccccc1)NC(=O)OCc1ccccc1)C(=O)N[C@@H](Cc1ccc(OC(C)(C)C)cc1)C(=O)OC(C)(C)C

nearest known ligand 0.59

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ ECE1 P42892 18/20 0.59
▸ MME P08473 15/20 0.59
▸ MMP8 P22894 1/20 0.51
▸ MMP14 P50281 1/20 0.51
▸ ACE P12821 1/20 0.49

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
SCHEMBL3862345 1.00 ECE1 (0.59) ECE1MMEMMP8MMP14ACE
SCHEMBL3865859 0.94 ECE1 (0.66) ECE1MMEMMP8MMP14
SCHEMBL3891517 0.83 ECE1 (0.75) ECE1MMEACE
SCHEMBL3891513 0.83 ECE1 (0.75) ECE1MMEACE
SCHEMBL3891509 0.83 ECE1 (0.75) ECE1MMEACE
SCHEMBL6927137 0.80 ECE1 (0.72) ECE1MME
SCHEMBL3865857 0.79 ECE1 (0.68) ECE1MME
SCHEMBL3868361 0.78 ECE1 (0.62) ECE1MMEMMP8MMP14
SCHEMBL22457264 0.78 CTSL (0.61) —
SCHEMBL13866600 0.78 ECE1 (0.62) ECE1MMEMMP8MMP14

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
US-7521469-B2 Phosphinic amino acid compounds LES LABORATOIRES SERVIER (FR) 2009-04-21 — — US disclosed