Sugi Predict

Sugi Predict / Compounds / SCHEMBL6924974

SCHEMBL6924974

SCHEMBL6924974

C[C@H](NC(=O)C(Cc1ccccc1)CP(=O)(O)C(Cc1ccccc1)NC(=O)OCc1ccccc1)C(=O)O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ ECE1 P42892 17/20 1.00
▸ MME P08473 15/20 1.00
▸ ACE2 Q9BYF1 1/20 0.71
▸ MMP8 P22894 1/20 0.70
▸ MMP14 P50281 1/20 0.70

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
SCHEMBL6922969 0.95 ECE1 (0.91) ECE1MME
SCHEMBL6927544 0.94 ECE1 (0.88) ECE1MMEACE2MMP8MMP14
SCHEMBL7621700 0.88 ECE1 (1.00) ECE1MME
SCHEMBL6928956 0.88 ECE1 (0.79) ECE1MMEMMP8MMP14
SCHEMBL6928069 0.88 ACE2 (0.81) ECE1MMEACE2
SCHEMBL6928745 0.87 ECE1 (0.77) ECE1MMEACE2MMP8MMP14
SCHEMBL6925939 0.86 ECE1 (0.88) ECE1MME
SCHEMBL6924717 0.85 ACE2 (0.84) ECE1MMEACE2MMP8MMP14
SCHEMBL6926704 0.84 ECE1 (0.86) ECE1MMEACE2
SCHEMBL7615297 0.83 ECE1 (0.76) ECE1MMEACE2

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
US-6518260-B1 (α-aminophosphino) peptide derivatives, method for making same and therapeutic applications thereof INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) 2003-02-11 — — US disclosed
EP-1009750-B1 NOVEL (ALPHA-AMINOPHOSPHINO) PEPTIDE DERIVATIVES, METHOD FOR MAKING SAME AND THERAPEUTIC APPLICATIONS THEREOF INST NAT SANTE RECH MED (FR) 2002-07-31 — — EP disclosed