SCHEMBL5695703

SCHEMBL5695703

C[C@H](CS)C(=O)N[C@@H](CSCc1ccc(I)cc1)C(=O)O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ACE P12821 18/20 1.00

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
SCHEMBL8074628 0.89 ACE (1.00) ACE
SCHEMBL5695709 0.89 ACE (1.00) ACE
SCHEMBL5695576 0.89 ACE (1.00) ACE
SCHEMBL5695594 0.89 ACE (1.00) ACE
SCHEMBL5695612 0.89 ACE (1.00) ACE
SCHEMBL5695578 0.88 ACE (1.00) ACE
SCHEMBL5696367 0.88 ACE (1.00) ACE
SCHEMBL5696359 0.88 ACE (1.00) ACE
SCHEMBL5695642 0.88 ACE (1.00) ACE
SCHEMBL5695742 0.88 ACE (1.00) ACE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0947502-B1 NOVEL SULFUR-CONTAINING AMINO ACID DERIVATIVES SANTEN PHARMACEUTICAL CO LTD (JP) 2006-06-21 EP claimed
US-6046235-A SULFUR-CONTAINING AMINO ACID DERIVATIVES WHICH HAVE INHIBITORY EFFECTS ON LEUKOTRIENE A4 HYDROLASE AND USEFUL AS THERAPEUTICAL AGENTS FOR INFLAMMATORY DISEASES SUCH AS RHEUMATISM, PSORIASIS, GOUT, CYSTIC FIBROSIS AND BOWL DISEASES SANTEN PHARMACEUTICAL CO., LTD. (JP) 2000-04-04 US claimed
EP-0947502-A1 NOVEL SULFUR-CONTAINING AMINO ACID DERIVATIVES SANTEN PHARMACEUTICAL CO., LTD. (JP) 1999-10-06 EP claimed
EP-0947502-B1 NOVEL SULFUR-CONTAINING AMINO ACID DERIVATIVES SANTEN PHARMACEUTICAL CO LTD (JP) 2006-06-21 EP disclosed
US-6046235-A SULFUR-CONTAINING AMINO ACID DERIVATIVES WHICH HAVE INHIBITORY EFFECTS ON LEUKOTRIENE A4 HYDROLASE AND USEFUL AS THERAPEUTICAL AGENTS FOR INFLAMMATORY DISEASES SUCH AS RHEUMATISM, PSORIASIS, GOUT, CYSTIC FIBROSIS AND BOWL DISEASES SANTEN PHARMACEUTICAL CO., LTD. (JP) 2000-04-04 US disclosed
EP-0947502-A1 NOVEL SULFUR-CONTAINING AMINO ACID DERIVATIVES SANTEN PHARMACEUTICAL CO., LTD. (JP) 1999-10-06 EP disclosed