SCHEMBL31039945

SCHEMBL31039945

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

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ CTSD P07339 4/20 0.41
▸ OPRM1 P35372 1/20 0.40
▸ OPRD1 P41143 1/20 0.40
▸ ALDH1A1 P00352 2/20 0.40
▸ BACE1 P56817 5/20 0.39
▸ LAP3 P28838 3/20 0.39
▸ MEN1 O00255 1/20 0.38
▸ LMNA P02545 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ REN P00797 1/20 0.38
▸ BACE2 Q9Y5Z0 1/20 0.38
▸ MMP2 P08253 1/20 0.38
▸ MMP9 P14780 1/20 0.38
▸ MMP8 P22894 1/20 0.38
▸ CTSB P07858 1/20 0.37
▸ SLC7A5 Q01650 1/20 0.37

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
SCHEMBL30011201 0.91 CTSD (0.43) CTSDALDH1A1BACE1LAP3MEN1
SCHEMBL11567509 0.89 BACE1 (0.50) CTSDBACE1BACE2
SCHEMBL11567515 0.89 BACE1 (0.50) CTSDBACE1BACE2
SCHEMBL11566796 0.88 ALDH1A1 (0.47) CTSDALDH1A1BACE1LAP3MEN1
SCHEMBL11566787 0.88 ALDH1A1 (0.47) CTSDALDH1A1BACE1LAP3MEN1
SCHEMBL11567184 0.88 ALDH1A1 (0.47) CTSDALDH1A1BACE1LAP3MEN1
SCHEMBL31630766 0.88 OPRM1 (0.45) CTSDOPRM1OPRD1ALDH1A1BACE1
SCHEMBL11567697 0.88 ALDH1A1 (0.47) CTSDALDH1A1BACE1LAP3MEN1
SCHEMBL29695545 0.88 OPRM1 (0.45) CTSDOPRM1OPRD1ALDH1A1BACE1
SCHEMBL11567194 0.88 ALDH1A1 (0.47) CTSDALDH1A1BACE1LAP3MEN1

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
CN-119220557-A Rice nitrogen efficient utilization gene OsNAC15, protein coded by same and application thereof 东北农业大学 2024-12-31 — — CN disclosed
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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