SCHEMBL30067104

SCHEMBL30067104

CC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)CN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)[C@@H](C)O)C(C)C

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 1/20 0.48
▸ CAPN1 P07384 2/20 0.47
▸ CALCRL Q16602 2/20 0.46
▸ F2 P00734 4/20 0.44
▸ NPY2R P49146 7/20 0.44
▸ NPY4R P50391 7/20 0.44
▸ NPY5R Q15761 7/20 0.44
▸ NPY1R P25929 5/20 0.44
▸ NTSR2 O95665 1/20 0.43
▸ NTSR1 P30989 1/20 0.43
▸ EP300 Q09472 1/20 0.43
▸ HIF1A Q16665 1/20 0.43

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
SCHEMBL8937022 0.88 CAPN1 (0.49) CAPN1CALCRLNTSR2NTSR1
SCHEMBL8937016 0.88 CAPN1 (0.49) CAPN1CALCRLNTSR2NTSR1
SCHEMBL30525421 0.88 CAPN1 (0.50) CAPN1NTSR2NTSR1
SCHEMBL8936975 0.86 MAPK8 (0.48) CAPN1
SCHEMBL8936981 0.86 MAPK8 (0.48) CAPN1
SCHEMBL30198507 0.85 NPY2R (0.48) CAPN1NPY2RNPY4RNPY5RNPY1R
SCHEMBL30666371 0.84 CAPN1 (0.53) CAPN1CALCRLNPY2RNPY4RNPY5R
SCHEMBL30067143 0.83 NTSR2 (0.51) NTSR2NTSR1
SCHEMBL29923206 0.83 CALCRL (0.52) PTPN1CALCRLNTSR2NTSR1EP300
SCHEMBL30722283 0.82 CAPN1 (0.48) PTPN1CAPN1CALCRLNTSR2NTSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240207308-A1 METHOD FOR CULTURING DENDRITIC CELLS NANOFAENTECH CO., Ltd. (KR) 2024-06-27 — — US disclosed
EP-4335919-A1 METHOD FOR CULTURING DENDRITIC CELLS Nanofaentech Co., Ltd. (KR) 2024-03-13 — — EP disclosed
WO-2022235072-A1 METHOD FOR CULTURING DENDRITIC CELLS 아주대학교산학협력단 2022-11-10 — — WO disclosed
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