SCHEMBL31668917

SCHEMBL31668917

CC[C@H](C)[C@H](NC(=O)[C@H](CCSC)NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@@H](N)CC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)O

nearest known ligand 0.60

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ CCKBR P32239 10/20 0.60
▸ CCKAR P32238 2/20 0.60
▸ PTH1R Q03431 2/20 0.55
▸ IL23R Q5VWK5 2/20 0.53
▸ RXFP1 Q9HBX9 1/20 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
SCHEMBL8716659 0.84 CCKBR (0.53) CCKBRCCKARPTH1R
SCHEMBL8716662 0.84 CCKBR (0.53) CCKBRCCKARPTH1R
SCHEMBL29590540 0.83 CCKBR (0.61) CCKBRCCKAR
SCHEMBL18541575 0.83 CCKBR (0.69) CCKBRCCKARIL23R
SCHEMBL29717264 0.83 CCKBR (0.61) CCKBRCCKAR
SCHEMBL29985848 0.82 CCKBR (0.61) CCKBRCCKARIL23R
SCHEMBL30932147 0.82 MAGI3 (0.56) CCKBRCCKARIL23R
SCHEMBL29359346 0.82 ERAP2 (0.57) —
SCHEMBL31013478 0.81 PTH1R (0.59) CCKARPTH1RIL23RRXFP1
SCHEMBL31013468 0.81 PTH1R (0.59) CCKARPTH1RIL23RRXFP1

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-12377048-B2 Methods of making neutral liposomes containing biologically active agents UNIVERSITY OF TENNESSEE RESEARCH FOUNDATION (US) 2025-08-05 — — US disclosed
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