SCHEMBL31039964

SCHEMBL31039964

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

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ BACE1 P56817 9/20 0.46
▸ CTSD P07339 4/20 0.46
▸ DPP4 P27487 2/20 0.44
▸ DPP8 Q6V1X1 2/20 0.44
▸ DPP9 Q86TI2 2/20 0.44
▸ ECE1 P42892 3/20 0.41
▸ PDCD1LG2 Q9BQ51 1/20 0.41
▸ CD274 Q9NZQ7 1/20 0.41
▸ PTGS1 P23219 1/20 0.39
▸ GSTK1 Q9Y2Q3 1/20 0.39
▸ ALOX15 P16050 1/20 0.38
▸ BLM P54132 1/20 0.38
▸ PMP22 Q01453 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ GLO1 Q04760 1/20 0.38

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
SCHEMBL30558188 0.89 DPP4 (0.48) BACE1CTSDDPP4DPP8DPP9
Ea-230 SCHEMBL29360663 0.84 NOD1 (0.44) DPP4DPP8DPP9ECE1PTGS1
SCHEMBL29808352 0.84 BACE1 (0.47) BACE1CTSDDPP4DPP8DPP9
SCHEMBL30720815 0.83 BACE1 (0.46) BACE1CTSDPTGS1GSTK1
SCHEMBL30939436 0.82 DPP4 (0.49) BACE1CTSDDPP4DPP8DPP9
SCHEMBL31321026 0.81 ECE1 (0.40) ECE1PDCD1LG2CD274
SCHEMBL31031517 0.81 BACE1 (0.44) BACE1CTSDDPP4DPP8DPP9
SCHEMBL5970284 0.81 DPP4 (0.59) BACE1CTSDDPP4DPP8DPP9
SCHEMBL537130 0.81 DPP4 (0.59) BACE1CTSDDPP4DPP8DPP9
SCHEMBL29431016 0.81 PTGS1 (0.44) BACE1CTSDDPP4DPP8DPP9

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
CN-116970080-B Anti-human MFAP5 monoclonal antibody and preparation method thereof, polynucleotide molecule, expression vector and host cell 优睿赛思(武汉)生物科技有限公司 2024-08-13 — — CN disclosed
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