SCHEMBL7361728

SCHEMBL7361728

N[C@@H](CC1CCCCC1)C(=O)C(F)(F)C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SLC1A3 P43003 3/20 0.37
SLC1A2 P43004 3/20 0.37
SLC1A1 P43005 3/20 0.37
METAP1 P53582 2/20 0.37
DPEP1 P16444 1/20 0.36
METAP2 P50579 1/20 0.36
ALOX5 P09917 1/20 0.36
GRM2 Q14416 1/20 0.36
GRM3 Q14832 1/20 0.36
GRIN2D O15399 4/20 0.35
GRIN3B O60391 4/20 0.35
GRIN1 Q05586 4/20 0.35
GRIN2A Q12879 4/20 0.35
GRIN2B Q13224 4/20 0.35
GRIN2C Q14957 4/20 0.35
GRIN3A Q8TCU5 4/20 0.35

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
SCHEMBL10354798 1.00 SLC1A3 (0.37) SLC1A3SLC1A2SLC1A1METAP1DPEP1
SCHEMBL10768614 1.00 SLC1A3 (0.37) SLC1A3SLC1A2SLC1A1METAP1DPEP1
SCHEMBL7440684 0.84 REN (0.38) METAP1METAP2ALOX5
SCHEMBL7440693 0.84 REN (0.38) METAP1METAP2ALOX5
Trifluoroacetic Acid SCHEMBL27759897 0.81 GRIN2D (0.42) SLC1A3SLC1A2SLC1A1GRIN2DGRIN3B
Trifluoroacetic Acid SCHEMBL3200966 0.81 GRIN2D (0.42) SLC1A3SLC1A2SLC1A1GRIN2DGRIN3B
SCHEMBL17789278 0.77 METAP1 (0.40) SLC1A3SLC1A2SLC1A1METAP1METAP2
SCHEMBL30415115 0.77 METAP1 (0.40) SLC1A3SLC1A2SLC1A1METAP1METAP2
SCHEMBL2652715 0.76 GRIN2D (0.49) SLC1A3SLC1A2SLC1A1GRIN2DGRIN3B
SCHEMBL123134 0.76 GRIN2D (0.49) SLC1A3SLC1A2SLC1A1GRIN2DGRIN3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0389535-A1 RENIN INHIBITORS, PROCESSES FOR PREPARING THEM, METHODS FOR USING THEM, AND COMPOSITIONS CONTAINING THEM WARNER-LAMBERT COMPANY (US) 1990-10-03 EP disclosed
EP-0387309-A1 RENIN INHIBITORS, PROCESS FOR PRODUCING THEM AND USE THEREOF SANDOZ AG (CH) 1990-09-19 EP disclosed
WO-1989010917-A2 RENIN INHIBITORS, PROCESS FOR PRODUCING THEM AND USE THEREOF SANDOZ AG (CH) 1989-11-16 WO disclosed
WO-1989007610-A1 RENIN INHIBITORS CONTAINING alpha-HETEROATOM AMINO ACIDS WARNER-LAMBERT COMPANY (US) 1989-08-24 WO disclosed
WO-1989003841-A1 RENIN INHIBITORS, PROCESSES FOR PREPARING THEM, METHODS FOR USING THEM, AND COMPOSITIONS CONTAINING THEM WARNER-LAMBERT COMPANY (US) 1989-05-05 WO disclosed
WO-1989003820-A1 BRANCHED BACKBONE RENIN INHIBITORS WARNER-LAMBERT COMPANY (US) 1989-05-05 WO disclosed
EP-0222523-A2 Difluorocyclostatine containing polypeptides PFIZER INC. (US) 1987-05-20 EP disclosed