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Sugi Predict / Compounds / SCHEMBL30099501

SCHEMBL30099501

SCHEMBL30099501

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

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ RXFP1 Q9HBX9 2/20 0.48
▸ TFPI P10646 1/20 0.47
▸ OPRL1 P41146 5/20 0.43
▸ IL23R Q5VWK5 1/20 0.43
▸ VIPR2 P41587 2/20 0.41
▸ VIPR1 P32241 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
SCHEMBL30844336 0.90 RXFP1 (0.54) RXFP1TFPIOPRL1IL23RVIPR2
SCHEMBL30099508 0.90 RXFP1 (0.44) RXFP1TFPIOPRL1IL23R
SCHEMBL31257159 0.88 TFPI (0.44) RXFP1TFPIVIPR2VIPR1
SCHEMBL29736292 0.87 OPRL1 (0.45) OPRL1
SCHEMBL29608297 0.86 NPY4R (0.49) —
SCHEMBL30804675 0.86 BACE1 (0.49) RXFP1TFPIVIPR2VIPR1
SCHEMBL30094613 0.86 OPRL1 (0.50) TFPIOPRL1IL23R
SCHEMBL30198545 0.85 TFPI (0.45) RXFP1TFPIIL23R
SCHEMBL28081112 0.84 TFPI (0.54) RXFP1TFPIOPRL1VIPR2VIPR1
SCHEMBL28081230 0.84 TFPI (0.54) RXFP1TFPIOPRL1VIPR2VIPR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250123280-A1 LABEL-FREE DETECTION OF PROTEASE ACTIVITY UNIV OREGON HEALTH & SCIENCE (US) 2025-04-17 — — US claimed
WO-2023003984-A2 LABEL-FREE DETECTION OF PROTEASE ACTIVITY OREGON HEALTH & SCIENCE UNIVERSITY (US) 2023-01-26 — — WO claimed
US-20250123280-A1 LABEL-FREE DETECTION OF PROTEASE ACTIVITY UNIV OREGON HEALTH & SCIENCE (US) 2025-04-17 — — US disclosed
WO-2023003984-A2 LABEL-FREE DETECTION OF PROTEASE ACTIVITY OREGON HEALTH & SCIENCE UNIVERSITY (US) 2023-01-26 — — WO disclosed
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