SCHEMBL30099583

SCHEMBL30099583

NCCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)Cc1ccccc1)C(=O)O

nearest known ligand 0.62

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ GNPAT O15228 1/20 0.56
▸ NAALAD2 Q9Y3Q0 1/20 0.56
▸ ERAP2 Q6P179 1/20 0.56
▸ LNPEP Q9UIQ6 1/20 0.56
▸ FOLH1 Q04609 4/20 0.55
▸ OPRK1 P41145 1/20 0.53
▸ MMP2 P08253 1/20 0.51
▸ LTA4H P09960 1/20 0.50
▸ ECE1 P42892 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
SCHEMBL29774691 1.00 GNPAT (0.56) GNPATNAALAD2ERAP2LNPEPFOLH1
SCHEMBL30099620 1.00 GNPAT (0.56) GNPATNAALAD2ERAP2LNPEPFOLH1
SCHEMBL29774693 1.00 GNPAT (0.56) GNPATNAALAD2ERAP2LNPEPFOLH1
SCHEMBL30099615 1.00 GNPAT (0.56) GNPATNAALAD2ERAP2LNPEPFOLH1
SCHEMBL29692934 0.98 ERAP2 (0.57) GNPATNAALAD2ERAP2LNPEPFOLH1
SCHEMBL30688850 0.96 GNPAT (0.53) GNPATNAALAD2ERAP2LNPEPFOLH1
SCHEMBL30099515 0.96 MMP2 (0.57) GNPATNAALAD2ERAP2LNPEPFOLH1
SCHEMBL29630562 0.94 MMP2 (0.55) GNPATNAALAD2ERAP2LNPEPFOLH1
SCHEMBL30740082 0.94 NAALAD2 (0.56) GNPATNAALAD2ERAP2LNPEPFOLH1
SCHEMBL30915103 0.94 GNPAT (0.62) GNPATERAP2LNPEPOPRK1MMP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250123280-A1 LABEL-FREE DETECTION OF PROTEASE ACTIVITY UNIV OREGON HEALTH & SCIENCE (US) 2025-04-17 — — US claimed
US-20250123280-A1 LABEL-FREE DETECTION OF PROTEASE ACTIVITY UNIV OREGON HEALTH & SCIENCE (US) 2025-04-17 — — US disclosed
WO-2023003984-A2 LABEL-FREE DETECTION OF PROTEASE ACTIVITY OREGON HEALTH & SCIENCE UNIVERSITY (US) 2023-01-26 — — WO disclosed
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