SCHEMBL31597641

SCHEMBL31597641

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

nearest known ligand 0.60

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 5/20 0.60
IL23R Q5VWK5 3/20 0.56
CTSB P07858 1/20 0.55
CTSK P43235 1/20 0.55
KISS1R Q969F8 5/20 0.54
MAGI3 Q5TCQ9 1/20 0.52
RXFP1 Q9HBX9 1/20 0.52

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
SCHEMBL31238559 0.98 GHSR (0.57) GHSRIL23RCTSBCTSKKISS1R
SCHEMBL31597621 0.95 ERAP2 (0.56) GHSRIL23RCTSBCTSKKISS1R
SCHEMBL30608430 0.94 ERAP2 (0.58) GHSRIL23RCTSBCTSKKISS1R
SCHEMBL31597505 0.93 MAGI3 (0.59) GHSRIL23RCTSBCTSKKISS1R
SCHEMBL31238575 0.91 KISS1R (0.59) GHSRIL23RCTSBCTSKKISS1R
SCHEMBL30020173 0.91 RXFP1 (0.64) IL23RRXFP1
SCHEMBL31597594 0.90 GRPR (0.58) GHSRIL23RCTSBCTSKKISS1R
SCHEMBL31597617 0.88 MAGI3 (0.62) GHSRIL23RCTSBCTSKKISS1R
SCHEMBL30608442 0.88 MAGI3 (0.61) GHSRIL23RCTSBCTSKKISS1R
SCHEMBL31597559 0.88 KISS1R (0.60) GHSRIL23RKISS1R

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
CN-120058859-A Hexapeptide compound, composition and application thereof 深圳市维琪科技股份有限公司 2025-05-30 CN disclosed