SCHEMBL11435650

SCHEMBL11435650

CC(C)C[C@H](NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H]1CCCN1C(=O)CCS)C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ REN P00797 16/20 0.56
▸ CTSD P07339 1/20 0.51
▸ PLK1 P53350 1/20 0.49
▸ TRHR P34981 1/20 0.47

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
SCHEMBL11436794 0.89 REN (0.54) RENCTSDPLK1TRHR
SCHEMBL11435645 0.85 PSMB9 (0.44) REN
SCHEMBL11435639 0.85 PSMB9 (0.44) REN
SCHEMBL17226098 0.82 REN (0.61) RENCTSDPLK1TRHR
SCHEMBL11240079 0.80 PSMB9 (0.52) REN
SCHEMBL11240100 0.80 PSMB9 (0.52) REN
SCHEMBL7849192 0.80 REN (0.65) RENCTSDPLK1
SCHEMBL7852891 0.80 REN (0.65) RENCTSDPLK1
SCHEMBL7842935 0.80 REN (0.65) RENCTSDPLK1
SCHEMBL31435690 0.79 REN (0.58) RENCTSDTRHR

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-4216209-A Tripeptide angiotensin converting enzyme inhibitors AMERICAN HOME PRODUCTS CORPORATION (US) 1980-08-05 — — US claimed
US-4216209-A Tripeptide angiotensin converting enzyme inhibitors AMERICAN HOME PRODUCTS CORPORATION (US) 1980-08-05 — — US disclosed
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