SCHEMBL10477772

SCHEMBL10477772

CC(C)CC(=O)NC(=O)C(O)[C@H](CC(C)C)NC(=O)[C@@H](N)Cc1c[nH]cn1

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ REN P00797 9/20 0.33
▸ PSMB5 P28074 1/20 0.33
▸ CTSD P07339 4/20 0.32
▸ MMP1 P03956 1/20 0.31
▸ MMP3 P08254 1/20 0.31
▸ MMP7 P09237 1/20 0.31

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
Hydrochloric Acid SCHEMBL10477703 0.99 REN (0.33) RENPSMB5CTSDMMP1MMP3
Hydrochloric Acid SCHEMBL10477759 0.99 REN (0.33) RENPSMB5CTSDMMP1MMP3
Hydrochloric Acid SCHEMBL10477780 0.89 REN (0.40) REN
Hydrochloric Acid SCHEMBL10477793 0.86 REN (0.33) REN
Hydrochloric Acid SCHEMBL10477671 0.84 REN (0.34) REN
Hydrochloric Acid SCHEMBL10477741 0.84 IL1RN (0.34) RENCTSD
Hydrochloric Acid SCHEMBL10477681 0.84 IL1RN (0.34) RENCTSD
SCHEMBL11124947 0.82 NPSR1 (0.40) REN
SCHEMBL29473464 0.80 REN (0.43) RENCTSD
SCHEMBL7277204 0.79 HSPA5 (0.36) REN

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
US-4857650-A Novel renin inhibitory amino acid derivatives KISSEI PHARMACEUTICAL CO., LTD. (JP) 1989-08-15 — — US disclosed
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