SCHEMBL29549877

SCHEMBL29549877

CC(C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)[C@@H](C)O

nearest known ligand 0.59

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ OPRD1 P41143 11/20 0.59
▸ OPRM1 P35372 10/20 0.59
▸ OPRK1 P41145 2/20 0.57
▸ CD40 P25942 2/20 0.48
▸ NPY1R P25929 1/20 0.48
▸ NPY2R P49146 1/20 0.48
▸ NPY4R P50391 1/20 0.48
▸ TFPI P10646 1/20 0.47
▸ IL23R Q5VWK5 1/20 0.47

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
SCHEMBL31257077 0.94 OPRM1 (0.57) OPRD1OPRM1OPRK1
SCHEMBL31257052 0.93 OPRM1 (0.58) OPRD1OPRM1OPRK1CD40TFPI
SCHEMBL31257013 0.93 OPRD1 (0.59) OPRD1OPRM1OPRK1CD40TFPI
SCHEMBL31314346 0.90 NPY4R (0.54) OPRD1OPRM1OPRK1NPY1RNPY2R
SCHEMBL31256995 0.89 OPRD1 (0.57) OPRD1OPRM1OPRK1CD40TFPI
SCHEMBL31257045 0.88 OPRM1 (0.56) OPRD1OPRM1OPRK1
SCHEMBL31257019 0.88 OPRD1 (0.57) OPRD1OPRM1OPRK1
SCHEMBL6519161 0.88 OPRM1 (0.54) OPRD1OPRM1OPRK1
SCHEMBL31243930 0.88 OPRD1 (0.65) OPRD1OPRM1OPRK1
SCHEMBL31689768 0.87 OPRD1 (0.57) OPRD1OPRM1OPRK1TFPIIL23R

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
CN-119431570-A Light chain and heavy chain variable region of anti-mycoplasma pneumoniae monoclonal antibody and application thereof 陕西省人民医院(陕西省临床医学研究院) 2025-02-14 — — CN claimed
CN-119431570-A Light chain and heavy chain variable region of anti-mycoplasma pneumoniae monoclonal antibody and application thereof 陕西省人民医院(陕西省临床医学研究院) 2025-02-14 — — CN disclosed
WO-2022068078-A1 ANTI-HUMAN CXCL-2 MONOCLONAL ANTIBODY 3-D3, AND CODING GENE AND USE THEREOF 浙江大学 2022-04-07 — — WO disclosed
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