SCHEMBL29630324

SCHEMBL29630324

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

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ERAP2 Q6P179 1/20 0.52
▸ LNPEP Q9UIQ6 1/20 0.52
▸ BACE1 P56817 7/20 0.50
▸ BACE2 Q9Y5Z0 2/20 0.50
▸ CTSD P07339 1/20 0.50
▸ MMP2 P08253 1/20 0.50
▸ MME P08473 1/20 0.49
▸ NAALAD2 Q9Y3Q0 1/20 0.49
▸ LTA4H P09960 1/20 0.49
▸ FOLH1 Q04609 1/20 0.49
▸ OPRK1 P41145 1/20 0.48

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
SCHEMBL29692934 0.95 ERAP2 (0.57) ERAP2LNPEPMMP2NAALAD2LTA4H
SCHEMBL29774693 0.93 GNPAT (0.56) ERAP2LNPEPMMP2NAALAD2LTA4H
SCHEMBL29774691 0.93 GNPAT (0.56) ERAP2LNPEPMMP2NAALAD2LTA4H
SCHEMBL30099583 0.93 GNPAT (0.56) ERAP2LNPEPMMP2NAALAD2LTA4H
SCHEMBL30099620 0.93 GNPAT (0.56) ERAP2LNPEPMMP2NAALAD2LTA4H
SCHEMBL30099615 0.93 GNPAT (0.56) ERAP2LNPEPMMP2NAALAD2LTA4H
SCHEMBL29763133 0.92 BACE1 (0.53) ERAP2LNPEPBACE1CTSDNAALAD2
SCHEMBL29763124 0.92 BACE1 (0.53) ERAP2LNPEPBACE1CTSDNAALAD2
SCHEMBL30740082 0.91 NAALAD2 (0.56) ERAP2LNPEPMMP2NAALAD2LTA4H
SCHEMBL30799162 0.91 ERAP2 (0.52) ERAP2LNPEPMMP2MMELTA4H

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-11807899-B2 Biochemical reaction methods and reagents comprising intrinsically disordered regions Biocrucible Limited 2023-11-07 — — US disclosed
US-20220145378-A1 BIOCHEMICAL REACTION METHODS AND REAGENTS COMPRISING INTRINSICALLY DISORDERED REGIONS Biocrucible Limited (GB) 2022-05-12 — — US disclosed
Send feedback