SCHEMBL23543178

SCHEMBL23543178

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

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.47
▸ MAPT P10636 1/20 0.46
▸ OPRD1 P41143 4/20 0.46
▸ OPRM1 P35372 2/20 0.46
▸ OPRK1 P41145 2/20 0.46
▸ LAP3 P28838 3/20 0.46
▸ MEN1 O00255 1/20 0.45
▸ LMNA P02545 1/20 0.45
▸ KMT2A Q03164 1/20 0.45
▸ NOD1 Q9Y239 1/20 0.43
▸ CTSB P07858 1/20 0.41
▸ FOLH1 Q04609 2/20 0.41
▸ MME P08473 1/20 0.41

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
SCHEMBL23543167 1.00 ALDH1A1 (0.47) ALDH1A1MAPTOPRD1OPRM1OPRK1
SCHEMBL11126832 1.00 ALDH1A1 (0.47) ALDH1A1MAPTOPRD1OPRM1OPRK1
SCHEMBL29590916 0.92 ALDH1A1 (0.51) ALDH1A1MAPTOPRD1OPRM1OPRK1
SCHEMBL5400268 0.90 OPRD1 (0.40) ALDH1A1MAPTOPRD1OPRM1OPRK1
SCHEMBL5400274 0.90 OPRD1 (0.40) ALDH1A1MAPTOPRD1OPRM1OPRK1
SCHEMBL30808874 0.90 OPRD1 (0.49) ALDH1A1MAPTOPRD1OPRM1OPRK1
SCHEMBL11127918 0.87 ALDH1A1 (0.49) ALDH1A1MAPTOPRD1OPRM1OPRK1
SCHEMBL30053170 0.86 ALDH1A1 (0.58) ALDH1A1MAPTLAP3MEN1LMNA
SCHEMBL31564802 0.86 ALDH1A1 (0.58) ALDH1A1MAPTLAP3MEN1LMNA
Alanyl-Dl-Leucine SCHEMBL2190468 0.86 ALDH1A1 (0.62) ALDH1A1MAPTLAP3MEN1LMNA

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
EP-3838913-A1 OLIGOPEPTIDE LINKER INTERMEDIATE AND PREPARATION METHOD THEREFOR MabPlex International Co., Ltd. (CN) 2021-06-23 — — EP disclosed
Send feedback