SCHEMBL29473696

SCHEMBL29473696

CC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CS)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CS)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)O)C(C)C

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ VIPR1 P32241 4/20 0.52
▸ GRIN2D O15399 1/20 0.51
▸ GRIN3B O60391 1/20 0.51
▸ GRIN1 Q05586 1/20 0.51
▸ GRIN2A Q12879 1/20 0.51
▸ GRIN2B Q13224 1/20 0.51
▸ GRIN2C Q14957 1/20 0.51
▸ GRIN3A Q8TCU5 1/20 0.51
▸ TFPI P10646 1/20 0.49
▸ VIPR2 P41587 6/20 0.48
▸ PTH1R Q03431 2/20 0.47
▸ KISS1R Q969F8 2/20 0.46
▸ RXFP1 Q9HBX9 2/20 0.46

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
SCHEMBL29473651 0.96 VIPR1 (0.53) VIPR1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL29473681 0.96 VIPR1 (0.54) VIPR1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL29475967 0.95 VIPR1 (0.50) VIPR1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL29473680 0.93 TFPI (0.51) VIPR1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL30662325 0.92 VIPR1 (0.58) VIPR1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL29473688 0.91 TFPI (0.51) VIPR1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL31019331 0.91 VIPR1 (0.53) VIPR1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL8877920 0.91 GRIN2D (0.51) VIPR1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL30712785 0.91 PTH1R (0.52) VIPR1VIPR2PTH1RRXFP1
SCHEMBL30168735 0.90 TFPI (0.52) VIPR1GRIN2DGRIN3BGRIN1GRIN2A

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
EP-4216992-A1 PARTICLE COMPRISING AN RSV-F PROTEIN FOR USE IN RSV VACCINATION DBV Technologies (FR) 2023-08-02 — — EP disclosed
WO-2022063990-A1 PARTICLE COMPRISING AN RSV-F PROTEIN FOR USE IN RSV VACCINATION DBV TECHNOLOGIES (FR) 2022-03-31 — — WO disclosed
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