SCHEMBL30819262

SCHEMBL30819262

C[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)CN)C(=O)N1CCC[C@H]1C(=O)NCC(=O)O

nearest known ligand 0.57

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ CTSL P07711 3/20 0.57
▸ CTSS P25774 3/20 0.57
▸ CTSK P43235 3/20 0.57
▸ CTSH P09668 1/20 0.57
▸ DPP3 Q9NY33 4/20 0.46
▸ GRPR P30550 3/20 0.46
▸ C5AR1 P21730 2/20 0.46
▸ NMBR P28336 2/20 0.46
▸ CCKAR P32238 1/20 0.45
▸ CCKBR P32239 1/20 0.45
▸ CAPN1 P07384 2/20 0.45
▸ CTSB P07858 2/20 0.45
▸ CXCR4 P61073 1/20 0.45

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
SCHEMBL30542894 0.93 CTSL (0.55) CTSLCTSSCTSKCTSHDPP3
SCHEMBL30542892 0.86 CTSL (0.65) CTSLCTSSCTSKCTSHC5AR1
SCHEMBL30183471 0.86 CTSL (0.53) CTSLCTSSCTSKCTSHC5AR1
SCHEMBL30542895 0.84 CTSL (0.43) CTSLCTSSCTSKCTSHGRPR
SCHEMBL30478003 0.84 DPP3 (0.52) DPP3CCKARCCKBRCAPN1CTSB
SCHEMBL30880117 0.83 CTSL (0.56) CTSLCTSSCTSKCTSHGRPR
SCHEMBL31396846 0.82 DPP3 (0.56) CTSLCTSSCTSKCTSHDPP3
SCHEMBL30362528 0.82 C5AR1 (0.55) GRPRC5AR1NMBRCAPN1CTSB
SCHEMBL30609009 0.81 CAPN1 (0.60) CTSLCTSSCTSKCTSHDPP3
SCHEMBL29565313 0.80 DPP3 (0.58) DPP3CCKBRCAPN1CTSBCXCR4

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
US-12357702-B2 Peptidic diagnostic compositions S. M. DISCOVERY GROUP INC. (US) 2025-07-15 — — US disclosed
US-20240131174-A1 PEPTIDIC BLOCKS FOR NUCLEIC ACID DELIVERY S. M. DISCOVERY GROUP INC. 2024-04-25 — — US disclosed
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