SCHEMBL7274162

SCHEMBL7274162

CC[C@H](O)[C@H](O)[C@@H](N)CC1CCCCC1

nearest known ligand 0.55

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
REN P00797 2/20 0.55
METAP2 P50579 7/20 0.44
METAP1 P53582 4/20 0.39
CYP1A2 P05177 1/20 0.36
ALDH1A1 P00352 1/20 0.34
KMT2A Q03164 1/20 0.34

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
SCHEMBL8913320 0.95 REN (0.50) RENMETAP2METAP1CYP1A2ALDH1A1
SCHEMBL8913322 0.95 REN (0.50) RENMETAP2METAP1CYP1A2ALDH1A1
SCHEMBL8913327 0.95 REN (0.50) RENMETAP2METAP1CYP1A2ALDH1A1
SCHEMBL9417322 0.86 REN (0.56) RENMETAP2METAP1CYP1A2ALDH1A1
SCHEMBL7274058 0.85 REN (0.49) RENMETAP2METAP1ALDH1A1KMT2A
SCHEMBL12507498 0.84 REN (0.49) RENMETAP2METAP1
SCHEMBL7272557 0.83 REN (0.49) RENMETAP2METAP1
SCHEMBL7301592 0.83 REN (0.49) RENMETAP2METAP1
SCHEMBL7272185 0.83 REN (0.49) RENMETAP2METAP1
SCHEMBL8910518 0.83 REN (0.49) RENMETAP2METAP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0229667-B1 Peptidylaminodiols ABBOTT LAB (US) 1994-07-13 EP disclosed
US-5214129-A Amidation of a protected amino acid by an di-O-protected dihydroxy-containing amine and coupling with a carboxylic acid; deprotecting; renin inhibitors; hypotensive agents ABBOTT LABORATORIES (US) 1993-05-25 US disclosed
EP-0499080-A2 Aminoacid derivatibes MERCK PATENT GmbH (DE) 1992-08-19 EP disclosed
US-5091575-A Renin inhibitor ABBOTT LABORATORIES (US) 1992-02-25 US disclosed
US-5063208-A Cardiovascular disorders, vision defects ABBOTT LABORATORIES (US) 1991-11-05 US disclosed
US-5032577-A Hypotensive ABBOTT LABORATORIES (US) 1991-07-16 US disclosed
EP-0410260-A2 Peptidyl aminodiol renin inhibitors ABBOTT LABORATORIES (US) 1991-01-30 EP disclosed
EP-0295294-A4 PEPTIDYLAMINODIOLS. ABBOTT LAB (US) 1990-04-10 EP disclosed
US-4845079-A HYPOTENSIVE, RENIN INHIBITION ABBOTT LABORATORIES 1989-07-04 US disclosed
EP-0295294-A1 PEPTIDYLAMINODIOLS ABBOTT LABORATORIES (US) 1988-12-21 EP disclosed
WO-1988005050-A1 PEPTIDYLAMINODIOLS ABBOTT LABORATORIES (US) 1988-07-14 WO disclosed
EP-0189203-A2 Peptidylaminodiols ABBOTT LABORATORIES (US) 1986-07-30 EP disclosed