SCHEMBL31475685

SCHEMBL31475685

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

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 2/20 0.55
DPP8 Q6V1X1 2/20 0.55
DPP9 Q86TI2 2/20 0.55
KMT2A Q03164 2/20 0.41
ALOX15 P16050 1/20 0.41
BLM P54132 1/20 0.41
PMP22 Q01453 1/20 0.41
OPRD1 P41143 4/20 0.40
BACE1 P56817 4/20 0.40
CTSD P07339 3/20 0.40
LMNA P02545 1/20 0.35
POLB P06746 1/20 0.35
PTGS1 P23219 1/20 0.33
GSTK1 Q9Y2Q3 1/20 0.33

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
SCHEMBL18339144 0.91 DPP4 (0.52) DPP4DPP8DPP9KMT2AALOX15
SCHEMBL31475681 0.85 OPRD1 (0.44) DPP4DPP8DPP9OPRD1BACE1
SCHEMBL31475680 0.84 DPP8 (0.46) DPP4DPP8DPP9OPRD1
SCHEMBL537130 0.83 DPP4 (0.59) DPP4DPP8DPP9KMT2AALOX15
SCHEMBL5970284 0.83 DPP4 (0.59) DPP4DPP8DPP9KMT2AALOX15
SCHEMBL31475679 0.82 BACE1 (0.55) OPRD1BACE1CTSD
SCHEMBL18339142 0.82 DPP4 (0.55) DPP4DPP8DPP9BLMOPRD1
SCHEMBL20542530 0.82 DPP4 (0.55) DPP4DPP8DPP9BLMOPRD1
SCHEMBL7541733 0.82 BLM (0.54) DPP4DPP8DPP9KMT2AALOX15
SCHEMBL7541728 0.82 BLM (0.54) DPP4DPP8DPP9KMT2AALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250129126-A1 LONG-LASTING HEPATITIS VIRUS ENTRY INHIBITOR Chengdu AODA Biotechnology Co., Ltd (CN) 2025-04-24 US disclosed