SCHEMBL11562020

SCHEMBL11562020

CCOC(=O)C(C)C(=O)N1CCC[C@H]1C(=O)OC(C)(C)C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FKBP1A P62942 3/20 0.46
▸ ACE P12821 9/20 0.41
▸ LMNA P02545 2/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ REN P00797 3/20 0.40
▸ PEPD P12955 2/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ F2 P00734 1/20 0.40
▸ LTA4H P09960 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ ALOX15 P16050 1/20 0.40
▸ PTGS1 P23219 1/20 0.40
▸ HTR2A P28223 1/20 0.40
▸ PTGS2 P35354 1/20 0.40
▸ HRH1 P35367 1/20 0.40
▸ THPO P40225 1/20 0.40
▸ PMP22 Q01453 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40
▸ ACE2 Q9BYF1 1/20 0.40

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
SCHEMBL10779744 0.87 ACE (0.52) FKBP1AACELMNARENPEPD
SCHEMBL1088066 0.84 FKBP1A (0.52) FKBP1ALMNAMEN1KMT2AKDM4E
SCHEMBL11558585 0.82 ACE (0.58) ACELMNARENPEPDKDM4E
SCHEMBL17955686 0.82 HSD17B10 (0.44) ACELMNARENPEPDKDM4E
SCHEMBL15223614 0.80 ACE (0.49) ACELMNARENPEPDKDM4E
SCHEMBL7270677 0.80 HSD17B10 (0.42) ACELMNAMEN1KMT2AREN
SCHEMBL7323258 0.80 DPP4 (0.50) ACELMNARENPEPDKDM4E
SCHEMBL10768669 0.80 HSD17B10 (0.42) ACELMNAMEN1KMT2AREN
SCHEMBL14682297 0.80 ACE (0.46) FKBP1AACELMNARENPEPD
SCHEMBL21166676 0.79 CTSL (0.51) FKBP1AACELMNAMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4154937-A ANGIOTENSIN CONVERTING ENZYME INHIBITORS E. R. SQUIBB & SONS, INC. (US) 1979-05-15 — — US disclosed
US-4128653-A Reduction of blood pressure with carboxyalkylacyl-pipecolic acid derivatives E. R. SQUIBB & SONS, INC. (US) 1978-12-05 — — US disclosed
US-4086338-A HYPOTENSIVE AGENTS, ANGIOTENSIN CONVERTING ENZYME INHIBITORS E. R. SQUIBB & SONS, INC. (US) 1978-04-25 — — US disclosed
US-4052511-A ANGIOTENSIN CONVERTING ENZYME INHIBITORS E. R. SQUIBB & SONS, INC. (US) 1977-10-04 — — US disclosed
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