SCHEMBL30023454

SCHEMBL30023454

CC(C)[C@H](N)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)O)[C@@H](C)O)C(C)C

nearest known ligand 0.64

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ DPP3 Q9NY33 5/20 0.64
▸ KISS1R Q969F8 4/20 0.61
▸ IL23R Q5VWK5 1/20 0.58
▸ OPRM1 P35372 2/20 0.57
▸ SLC6A2 P23975 1/20 0.55
▸ C5AR1 P21730 1/20 0.53
▸ CAPN1 P07384 2/20 0.53
▸ CTSB P07858 2/20 0.53

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
SCHEMBL34463648 0.93 KISS1R (0.62) DPP3KISS1RIL23RC5AR1
SCHEMBL30268594 0.93 IL23R (0.66) DPP3KISS1RIL23RC5AR1
SCHEMBL38661114 0.92 KISS1R (0.62) DPP3KISS1RIL23ROPRM1
SCHEMBL31071616 0.91 DPP3 (0.73) DPP3KISS1ROPRM1SLC6A2
SCHEMBL29804127 0.91 DPP3 (0.73) DPP3KISS1ROPRM1SLC6A2
SCHEMBL31307225 0.90 IL23R (0.65) KISS1RIL23RC5AR1
SCHEMBL19787869 0.89 DPP3 (0.69) DPP3OPRM1SLC6A2C5AR1CAPN1
SCHEMBL30392261 0.89 DPP3 (0.61) DPP3KISS1ROPRM1SLC6A2CAPN1
SCHEMBL31332280 0.89 KISS1R (0.64) KISS1RIL23RC5AR1
SCHEMBL31090175 0.89 DPP3 (0.77) DPP3KISS1ROPRM1SLC6A2

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-115244401-A DPP3 for therapy guidance, monitoring and stratification of NT-ADM antibodies in shock patients 4TEEN4制药有限公司 2022-10-25 — — CN claimed
CN-115769076-A DPP3 in patients infected with coronaviruses 4TEEN4制药有限公司 2023-03-07 — — CN disclosed
CN-115244401-A DPP3 for therapy guidance, monitoring and stratification of NT-ADM antibodies in shock patients 4TEEN4制药有限公司 2022-10-25 — — CN disclosed
Send feedback