SCHEMBL9439818

SCHEMBL9439818

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

nearest known ligand 0.58

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MME P08473 2/20 0.57
▸ ECE1 P42892 2/20 0.57
▸ CTSL P07711 3/20 0.57
▸ CTSB P07858 2/20 0.57
▸ CTSS P25774 2/20 0.57
▸ CTSK P43235 1/20 0.57
▸ CAPN1 P07384 1/20 0.56
▸ TACR1 P25103 2/20 0.55
▸ ALDH1A1 P00352 1/20 0.53
▸ ALOX15 P16050 1/20 0.53

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
SCHEMBL9440145 0.93 ALDH1A1 (0.59) CTSLCTSBCTSSCTSKCAPN1
SCHEMBL25287172 0.91 ECE1 (0.61) MMEECE1CTSLCTSBCTSS
SCHEMBL3058668 0.91 ECE1 (0.61) MMEECE1CTSLCTSBCTSS
SCHEMBL10985362 0.90 CTSS (0.53) CTSLCTSBCTSSCTSKCAPN1
SCHEMBL8612642 0.87 ECE1 (0.64) MMEECE1CTSLCTSBCTSS
SCHEMBL8585984 0.87 ECE1 (0.57) MMEECE1CTSLCTSBCTSS
SCHEMBL28252140 0.87 ECE1 (0.64) MMEECE1CTSLCTSBCTSS
SCHEMBL11148538 0.86 MME (0.58) MMEECE1CTSLCTSBCTSS
SCHEMBL6271137 0.86 CASP3 (0.64) MMEECE1CTSLCTSBCTSS
SCHEMBL9830575 0.86 CAPN1 (0.62) MMEECE1CTSLCTSBCTSS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0470175-A1 ENZYMATIC MEMBRANE METHOD FOR THE SYNTHESIS AND SEPARATION OF PEPTIDES THE COCA-COLA COMPANY (US) 1992-02-12 — — EP claimed
WO-1990012883-A1 ENZYMATIC MEMBRANE METHOD FOR THE SYNTHESIS AND SEPARATION OF PEPTIDES THE COCA-COLA COMPANY (US) 1990-11-01 — — WO claimed
US-5350681-A Aspartame THE COCA-COLA COMPANY (US) 1994-09-27 — — US disclosed
US-5336601-A Enzymatic membrane method for the snythesis and separation of peptides THE COCA-COLA COMPANY (US) 1994-08-09 — — US disclosed
EP-0470175-A1 ENZYMATIC MEMBRANE METHOD FOR THE SYNTHESIS AND SEPARATION OF PEPTIDES THE COCA-COLA COMPANY (US) 1992-02-12 — — EP disclosed
WO-1990012883-A1 ENZYMATIC MEMBRANE METHOD FOR THE SYNTHESIS AND SEPARATION OF PEPTIDES THE COCA-COLA COMPANY (US) 1990-11-01 — — WO disclosed
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