SCHEMBL31276246

SCHEMBL31276246

CC(C)C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCC(N)=O)C(C)C)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N1CCC[C@H]1C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ F2 P00734 4/20 0.54
▸ CALCR P30988 7/20 0.51
▸ APLNR P35414 2/20 0.47
▸ MC4R P32245 1/20 0.47
▸ NMBR P28336 2/20 0.47
▸ GRPR P30550 2/20 0.47
▸ C5AR1 P21730 2/20 0.47
▸ RAMP3 O60896 3/20 0.44

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
SCHEMBL29778026 0.84 F2 (0.54) F2CALCRAPLNRRAMP3
SCHEMBL29521043 0.84 F2 (0.54) F2CALCRAPLNRRAMP3
SCHEMBL31031589 0.84 F2 (0.61) F2CALCRAPLNRMC4RRAMP3
SCHEMBL31182995 0.83 CALCR (0.63) F2CALCRRAMP3
SCHEMBL30978823 0.83 F2 (0.58) F2CALCRMC4RNMBRGRPR
SCHEMBL30658564 0.82 F2 (0.58) F2CALCRNMBRGRPRC5AR1
SCHEMBL31453820 0.82 F2 (0.55) F2CALCRAPLNRMC4RNMBR
SCHEMBL29679930 0.82 F2 (0.50) F2CALCRAPLNRMC4RNMBR
SCHEMBL30258236 0.82 F2 (0.45) F2CALCRAPLNRMC4R
SCHEMBL30661447 0.82 MC4R (0.45) F2MC4R

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
WO-2025015401-A1 A METHOD OF IDENTIFYING HPV BIOMARKERS, A METHOD OF PREPARING A LATERAL FLOW DEVICE, SAID DEVICE AND A DIAGNOSTIC KIT UNIVERSIDADE ESTADUAL DE CAMPINAS (BR) 2025-01-23 — — WO disclosed
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