SCHEMBL29674916

SCHEMBL29674916

C[C@H](NC(=O)CNC(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)NCC(=O)NCC(=O)NCC(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CS)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ EPHA2 P29317 2/20 0.54
▸ CXCR4 P61073 2/20 0.53
▸ NMUR2 Q9GZQ4 5/20 0.53
▸ NMUR1 Q9HB89 5/20 0.53
▸ RAMP3 O60896 3/20 0.52
▸ CALCR P30988 3/20 0.52
▸ OPRM1 P35372 1/20 0.50
▸ OPRD1 P41143 1/20 0.50
▸ MAPK8 P45983 1/20 0.49
▸ MAPK9 P45984 1/20 0.49
▸ MAPK10 P53779 1/20 0.49
▸ NPY2R P49146 3/20 0.48
▸ NPY4R P50391 3/20 0.48
▸ NPY5R Q15761 3/20 0.48
▸ NPY1R P25929 2/20 0.48
▸ F2 P00734 1/20 0.48

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
SCHEMBL29674947 1.00 EPHA2 (0.54) EPHA2CXCR4NMUR2NMUR1RAMP3
SCHEMBL29392901 0.88 EPHA2 (0.57) EPHA2CXCR4NMUR2NMUR1MAPK8
SCHEMBL29895404 0.88 CXCR4 (0.61) CXCR4
SCHEMBL29674968 0.88 CXCR4 (0.61) CXCR4
SCHEMBL29674837 0.88 CXCR4 (0.61) CXCR4
SCHEMBL31473050 0.87 CXCR4 (0.61) EPHA2CXCR4NMUR2NMUR1RAMP3
SCHEMBL30186436 0.86 CXCR4 (0.58) EPHA2CXCR4NMUR2NMUR1RAMP3
SCHEMBL31182904 0.86 NMUR2 (0.65) CXCR4NMUR2NMUR1RAMP3CALCR
SCHEMBL30186407 0.86 EPHA2 (0.58) EPHA2CXCR4NMUR2NMUR1RAMP3
SCHEMBL29389698 0.86 EPHA2 (0.56) EPHA2CXCR4NPY2RNPY4RNPY5R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110437311-B Polypeptide and application thereof 南京安吉生物科技有限公司 2022-05-20 — — CN claimed
US-12404303-B2 Polypeptide and use thereof Nanjing Anji Biological Technology Co., Ltd. (CN) 2025-09-02 — — US disclosed
US-20220281916-A1 POLYPEPTIDE AND USE THEREOF Nanjing Anji Biological Technology Co., Ltd. (CN) 2022-09-08 — — US disclosed
CN-110437311-B Polypeptide and application thereof 南京安吉生物科技有限公司 2022-05-20 — — CN disclosed
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