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Sugi Predict / Compounds / SCHEMBL30763301

SCHEMBL30763301

SCHEMBL30763301

CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CS)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O

nearest known ligand 0.70

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CALCR P30988 5/20 0.70
▸ MC4R P32245 1/20 0.62
▸ NPY2R P49146 7/20 0.61
▸ NPY4R P50391 7/20 0.61
▸ NPY5R Q15761 7/20 0.61
▸ NPY1R P25929 5/20 0.61
▸ HCRTR1 O43613 1/20 0.61
▸ HCRTR2 O43614 1/20 0.61
▸ RAMP3 O60896 1/20 0.60
▸ TFPI P10646 3/20 0.60
▸ F2 P00734 1/20 0.60

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
SCHEMBL30763295 0.98 CALCR (0.73) CALCRNPY2RNPY4RNPY5RNPY1R
SCHEMBL29706208 0.97 CALCR (0.70) CALCRMC4RNPY2RNPY4RNPY5R
SCHEMBL29860218 0.95 MC4R (0.64) CALCRMC4RNPY2RNPY4RNPY5R
SCHEMBL29588650 0.95 MC4R (0.64) CALCRMC4RNPY2RNPY4RNPY5R
SCHEMBL29783623 0.94 CALCR (0.75) CALCRRAMP3TFPI
SCHEMBL29783622 0.94 CALCR (0.75) CALCRRAMP3TFPI
SCHEMBL29812571 0.94 CALCR (0.71) CALCRNPY2RNPY4RNPY5RNPY1R
SCHEMBL30752384 0.93 CALCR (0.71) CALCRNPY2RNPY4RNPY5RNPY1R
SCHEMBL31167610 0.92 CALCR (0.71) CALCRNPY2RNPY4RNPY5RNPY1R
SCHEMBL30752380 0.92 CALCR (0.71) CALCRNPY2RNPY4RNPY5RNPY1R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12497644-B2 Subtilisin variants and their use Fresenius Kabi Ipsum S.R.L. (IT) 2025-12-16 — — US disclosed
EP-4291647-B1 SUBTILISIN VARIANTS AND THEIR USE FRESENIUS KABI IPSUM S R L (IT) 2025-06-18 — — EP disclosed
US-20240043897-A1 SUBTILISIN VARIANTS AND THEIR USE Fresenius Kabi Ipsum S.R.L. (IT) 2024-02-08 — — US disclosed