SCHEMBL31016486

SCHEMBL31016486

C[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)CN)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CTSL P07711 3/20 0.55
▸ CTSS P25774 3/20 0.55
▸ CTSK P43235 3/20 0.55
▸ CTSH P09668 1/20 0.55
▸ CXCR4 P61073 2/20 0.50
▸ GLP1R P43220 5/20 0.49
▸ CCKBR P32239 3/20 0.49
▸ CCKAR P32238 1/20 0.49
▸ OPRD1 P41143 1/20 0.49
▸ IL23R Q5VWK5 1/20 0.49
▸ NPBWR1 P48145 1/20 0.47
▸ KEAP1 Q14145 1/20 0.47
▸ C5AR1 P21730 1/20 0.47
▸ GRPR P30550 1/20 0.47
▸ MC4R P32245 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
SCHEMBL31016482 0.98 CTSL (0.54) CTSLCTSSCTSKCTSHCXCR4
SCHEMBL31016480 0.93 CTSL (0.63) CTSLCTSSCTSKCTSHCXCR4
SCHEMBL30676242 0.93 CTSL (0.53) CTSLCTSSCTSKCTSHIL23R
SCHEMBL31016493 0.92 CTSL (0.60) CTSLCTSSCTSKCTSHCXCR4
SCHEMBL31016485 0.92 CTSL (0.60) CTSLCTSSCTSKCTSHCXCR4
SCHEMBL31016489 0.92 CTSL (0.60) CTSLCTSSCTSKCTSHCXCR4
SCHEMBL30037495 0.92 MC4R (0.52) CTSLCTSSCTSKCTSHCCKBR
SCHEMBL31016484 0.90 GLP1R (0.57) CTSLCTSSCTSKCTSHGLP1R
SCHEMBL31016488 0.89 ACE (0.51) CCKBRCCKAROPRD1
SCHEMBL29910876 0.89 NPBWR1 (0.56) CTSLCTSSCTSKCTSHCXCR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118402973-A Application of Qiya seed peptide and derivatives thereof in cosmetics 上海湃肽生物科技有限公司 2024-07-30 — — CN claimed
CN-118402973-A Application of Qiya seed peptide and derivatives thereof in cosmetics 上海湃肽生物科技有限公司 2024-07-30 — — CN disclosed
Send feedback