SCHEMBL31256950

SCHEMBL31256950

C[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N1CCC[C@H]1C(=O)NCC(=O)O

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ CTSL P07711 3/20 0.51
▸ CTSS P25774 3/20 0.51
▸ CTSK P43235 3/20 0.51
▸ CTSH P09668 1/20 0.51
▸ APLNR P35414 2/20 0.46
▸ MC4R P32245 1/20 0.46
▸ C5AR1 P21730 1/20 0.44
▸ OPRM1 P35372 6/20 0.44
▸ OPRK1 P41145 6/20 0.44
▸ RAMP3 O60896 3/20 0.43
▸ CALCR P30988 3/20 0.43
▸ CXCR4 P61073 1/20 0.43
▸ EPHA2 P29317 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
SCHEMBL34464614 0.87 CTSL (0.50) CTSLCTSSCTSKCTSHAPLNR
SCHEMBL30064478 0.85 C5AR1 (0.54) CTSLCTSSCTSKCTSHAPLNR
SCHEMBL29802046 0.85 OPRM1 (0.54) CTSLCTSSCTSKCTSHAPLNR
SCHEMBL30149043 0.83 CTSL (0.53) CTSLCTSSCTSKCTSHAPLNR
SCHEMBL29607506 0.83 APLNR (0.56) CTSLCTSSCTSKCTSHAPLNR
SCHEMBL31573963 0.83 APLNR (0.50) CTSLCTSSCTSKCTSHAPLNR
SCHEMBL31157044 0.83 CTSL (0.52) CTSLCTSSCTSKCTSHAPLNR
SCHEMBL9295105 0.83 C5AR1 (0.52) CTSLCTSSCTSKCTSHAPLNR
SCHEMBL29606819 0.82 APLNR (0.57) CTSLCTSSCTSKCTSHAPLNR
SCHEMBL30776248 0.82 MC4R (0.45) CTSLCTSSCTSKCTSHAPLNR

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
US-20240352445-A1 HUMANIZATION, AFFINITY MATURATION, AND OPTIMIZATION METHODS FOR PROTEINS AND ANTIBODIES ABWIZ BIO, INC. 2024-10-24 — — US disclosed
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