SCHEMBL24725321

SCHEMBL24725321

CC(C)C[C@H](NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CN)C(N)=O

nearest known ligand 0.61

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ GHSR Q92847 8/20 0.61
▸ ECE1 P42892 1/20 0.56
▸ REN P00797 2/20 0.56
▸ KISS1R Q969F8 1/20 0.55
▸ NMBR P28336 2/20 0.55
▸ GRPR P30550 1/20 0.54

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
SCHEMBL18862464 0.92 GHSR (0.62) GHSRECE1RENKISS1RNMBR
SCHEMBL18862458 0.90 GHSR (0.70) GHSR
SCHEMBL18862055 0.89 GHSR (0.57) GHSRRENKISS1RGRPR
SCHEMBL18862366 0.87 GHSR (0.60) GHSRECE1RENKISS1RNMBR
SCHEMBL27624890 0.86 SLC15A2 (0.61) REN
SCHEMBL18854269 0.85 GHSR (0.60) GHSRRENGRPR
SCHEMBL22722178 0.85 GHSR (0.65) GHSRECE1RENNMBRGRPR
SCHEMBL18854323 0.85 GHSR (0.59) GHSRRENKISS1R
SCHEMBL30051404 0.83 ECE1 (0.68) ECE1
SCHEMBL9822645 0.83 ECE1 (0.68) ECE1

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-2022235699-A2 POTENT ASGPR-BINDING COMPOUNDS FOR THE DEGRADATION OF IMMUNOGLOBULINS AND OTHER PROTEINS AVILAR THERAPEUTICS, INC. (US) 2022-11-10 — — WO disclosed
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