SCHEMBL10554484

SCHEMBL10554484

O=C(O)[C@@H]1CCCN1C(=O)C(CS)CS

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ ACE P12821 7/20 0.71
▸ REN P00797 4/20 0.71
▸ LMNA P02545 2/20 0.71
▸ HSD17B10 Q99714 2/20 0.71
▸ KDM4E B2RXH2 1/20 0.71
▸ F2 P00734 1/20 0.71
▸ LTA4H P09960 1/20 0.71
▸ MAPT P10636 1/20 0.71
▸ PEPD P12955 1/20 0.71
▸ ALOX15 P16050 1/20 0.71
▸ PTGS1 P23219 1/20 0.71
▸ HTR2A P28223 1/20 0.71
▸ PTGS2 P35354 1/20 0.71
▸ HRH1 P35367 1/20 0.71
▸ THPO P40225 1/20 0.71
▸ PMP22 Q01453 1/20 0.71
▸ ACE2 Q9BYF1 1/20 0.71
▸ CYP2C19 P33261 1/20 0.54

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
SCHEMBL11433749 0.95 ACE (0.65) ACERENLMNAHSD17B10KDM4E
SCHEMBL10554261 0.92 ACE (0.66) ACERENLMNAHSD17B10KDM4E
SCHEMBL7127497 0.91 ACE (0.68) ACERENLMNAHSD17B10KDM4E
SCHEMBL10551301 0.91 ACE (0.64) ACERENLMNAHSD17B10KDM4E
SCHEMBL11328302 0.91 ACE (0.64) ACERENLMNAHSD17B10KDM4E
SCHEMBL11376979 0.91 ACE (0.68) ACERENLMNAHSD17B10KDM4E
SCHEMBL10552002 0.88 ACE (0.61) ACERENLMNAHSD17B10KDM4E
SCHEMBL11375839 0.88 ACE (0.65) ACERENLMNAHSD17B10KDM4E
SCHEMBL11375851 0.88 ACE (0.65) ACERENLMNAHSD17B10KDM4E
SCHEMBL10555170 0.88 ACE (0.65) ACERENLMNAHSD17B10KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4833152-A Anti-hypertensive agents UNIVERSITY OF MIAMI (US) 1989-05-23 — — US disclosed
US-4745124-A THIO/ESTER PEPTIDES UNIVERSITY OF MIAMI (US) 1988-05-17 — — US disclosed
US-4734420-A INHIBITORS OF ANGIOTENSIN CONVERTING ENZYME UNIVERSITY OF MIAMI (US) 1988-03-29 — — US disclosed
US-4692458-A Anti-hypertensive agents UNIVERSITY OF MIAMI (US) 1987-09-08 — — US disclosed
US-4690936-A AMINO ACIDS, THIOESTER LINKAGE; ANGIOTENSIN INHIBITORS UNIVERSITY OF MIAMI (US) 1987-09-01 — — US disclosed
EP-0036713-B1 ANGIOTENSIN CONVERTING ENZYME INHIBITORS UNIVERSITY OF MIAMI (US) 1984-01-18 — — EP disclosed
EP-0036713-A2 Angiotensin converting enzyme inhibitors UNIVERSITY OF MIAMI (US) 1981-09-30 — — EP disclosed
US-4228077-A N-[2-(mercaptoalkyl)-3-mercaptoalkanoyl]-l-tryptophanes E. R. SQUIBB & SONS, INC. (US) 1980-10-14 — — US disclosed
US-4206121-A ANGIOTENSIN, ENZYME INHIBITORS E. R. SQUIBB & SONS, INC. (US) 1980-06-03 — — US disclosed
US-4178291-A HYPOTENSIVE AGENTS, ENZYME INHIBITORS E. R. SQUIBB & SONS, INC. (US) 1979-12-11 — — US disclosed
US-4176235-A ANGIOTENSIN COVERTING ENZYME INHIBITORS E. R. SQUIBB & SONS, INC. (US) 1979-11-27 — — US disclosed
US-4175199-A Substituted acyl derivatives of amino acids E. R. SQUIBB & SONS, INC. (US) 1979-11-20 — — US disclosed
US-4154936-A ENZYME INHIBITORS, HYPOTENSIVE E. R. SQUIBB & SONS, INC. (US) 1979-05-15 — — US disclosed
US-4140864-A ANGIOTENSIN CONVERTING ENZYME INHIBITORS E. R. SQUIBB & SONS, INC. (US) 1979-02-20 — — US disclosed
US-4116962-A ANGIOTENSIN CONVERTING ENXYME INHIBITORS E. R. SQUIBB & SONS, INC. (US) 1978-09-26 — — US disclosed
Send feedback