SCHEMBL30607481

SCHEMBL30607481

CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)CNC(=O)[C@@H](N)CC(=O)O)[C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C(C)C)[C@@H](C)O

nearest known ligand 0.72

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ NPY2R P49146 8/20 0.67
▸ NPY4R P50391 8/20 0.67
▸ NPY5R Q15761 8/20 0.67
▸ NPY1R P25929 6/20 0.67
▸ RAMP3 O60896 3/20 0.66
▸ CALCR P30988 3/20 0.66
▸ EP300 Q09472 1/20 0.63
▸ HIF1A Q16665 1/20 0.63
▸ TFPI P10646 4/20 0.61
▸ NMUR2 Q9GZQ4 3/20 0.61
▸ NMUR1 Q9HB89 3/20 0.61

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
SCHEMBL31683303 0.91 NPY2R (0.66) NPY2RNPY4RNPY5RNPY1RRAMP3
SCHEMBL30495721 0.90 NPY2R (0.65) NPY2RNPY4RNPY5RNPY1RRAMP3
SCHEMBL31182744 0.90 NPY2R (0.67) NPY2RNPY4RNPY5RNPY1RRAMP3
SCHEMBL30495834 0.89 RAMP3 (0.68) NPY2RNPY4RNPY5RNPY1RRAMP3
SCHEMBL30432086 0.89 RAMP3 (0.63) NPY2RNPY4RNPY5RNPY1RRAMP3
SCHEMBL29551993 0.89 NPY2R (0.63) NPY2RNPY4RNPY5RNPY1RRAMP3
SCHEMBL30495664 0.89 NPY2R (0.69) NPY2RNPY4RNPY5RNPY1RRAMP3
SCHEMBL30906476 0.88 NPY2R (0.71) NPY2RNPY4RNPY5RNPY1RRAMP3
SCHEMBL31683488 0.88 RAMP3 (0.69) NPY2RNPY4RNPY5RNPY1RRAMP3
SCHEMBL31182566 0.88 TFPI (0.68) NPY2RNPY4RNPY5RNPY1RCALCR

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
US-12383505-B2 Nanoparticle for the remodeling of cancer-associated fibroblasts UNIVERSITY OF SOUTH CAROLINA (US) 2025-08-12 — — US disclosed
US-20230310331-A1 NANOPARTICLE FOR THE REMODELING OF CANCER-ASSOCIATED FIBROBLASTS UNIVERSITY OF SOUTH CAROLINA (US) 2023-10-05 — — US disclosed
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