SCHEMBL30120656

SCHEMBL30120656

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

nearest known ligand 0.71

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ GNPAT O15228 1/20 0.58
▸ F2 P00734 2/20 0.56
▸ CTSD P07339 9/20 0.56
▸ PSEN1 P49768 2/20 0.48
▸ PSEN2 P49810 2/20 0.48
▸ APH1B Q8WW43 2/20 0.48
▸ NCSTN Q92542 2/20 0.48
▸ APH1A Q96BI3 2/20 0.48
▸ PSENEN Q9NZ42 2/20 0.48
▸ MME P08473 1/20 0.48
▸ ACE P12821 1/20 0.48
▸ CPA1 P15085 1/20 0.48
▸ ACE2 Q9BYF1 1/20 0.48
▸ REN P00797 1/20 0.48
▸ NTSR2 O95665 1/20 0.48
▸ NTSR1 P30989 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
SCHEMBL29438956 0.94 F2 (0.55) GNPATF2CTSDPSEN1PSEN2
SCHEMBL29493698 0.91 CTSD (0.56) GNPATF2CTSDPSEN1PSEN2
SCHEMBL30450986 0.90 F2 (0.57) GNPATF2CTSDPSEN1PSEN2
SCHEMBL31643032 0.90 CTSD (0.54) GNPATF2CTSDMMEACE
SCHEMBL30239118 0.88 BACE1 (0.55) F2CTSDNTSR2NTSR1
SCHEMBL10379929 0.85 GNPAT (0.54) GNPATCTSD
SCHEMBL10379927 0.85 GNPAT (0.54) GNPATCTSD
SCHEMBL3801759 0.85 GNPAT (0.78) GNPATCPA1ACE2
SCHEMBL8933580 0.85 GNPAT (0.78) GNPATCPA1ACE2
SCHEMBL29368954 0.85 GNPAT (0.78) GNPATCPA1ACE2

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-20240252716-A1 SELF-ASSEMBLING NANOFIBROUS ULTRASHORT PEPTIDE HYDROGELS FOR VASCULAR TISSUE ENGINEERING TECHNOLOGY, KING ABDULLAH UNIVERSITY OF SCIENCE AND, TECH (SA) 2024-08-01 — — US disclosed
WO-2022254312-A1 SELF-ASSEMBLING NANOFIBROUS ULTRASHORT PEPTIDE HYDROGELS FOR VASCULAR TISSUE ENGINEERING KING ADBULLAH UNIVERSITY OF SCIENCE AND TECHNOLOGY (SA) 2022-12-08 — — WO disclosed
Send feedback