SCHEMBL8615386

SCHEMBL8615386

CCOC(=O)C1CCC(=O)N1CCN[C]=O

nearest known ligand 0.45

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ADRA1A P35348 2/20 0.45
ADRA1D P25100 1/20 0.45
ADRA1B P35368 1/20 0.45
USP2 O75604 2/20 0.40
KMT2A Q03164 1/20 0.39
ALDH1A1 P00352 3/20 0.38
P2RX7 Q99572 8/20 0.37

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
SCHEMBL8615391 0.82 ADRA1A (0.43) ADRA1AADRA1DADRA1BUSP2KMT2A
SCHEMBL8613094 0.81 ACE (0.40) USP2KMT2AALDH1A1P2RX7
SCHEMBL8614999 0.80 P2RX7 (0.34) USP2KMT2AALDH1A1P2RX7
SCHEMBL11949260 0.79 P2RX7 (0.49) ADRA1AKMT2AP2RX7
SCHEMBL2575919 0.79 P2RX7 (0.49) ADRA1AKMT2AP2RX7
SCHEMBL2575921 0.79 P2RX7 (0.49) ADRA1AKMT2AP2RX7
SCHEMBL13331904 0.79 ALDH1A1 (0.48) ADRA1AADRA1DADRA1BUSP2KMT2A
SCHEMBL9150751 0.77 ALDH1A1 (0.50) ADRA1AADRA1DADRA1BUSP2KMT2A
SCHEMBL28637480 0.76 ADRA1A (0.40) ADRA1AADRA1DADRA1BKMT2AALDH1A1
SCHEMBL9542954 0.75 ADRA1A (0.46) ADRA1AADRA1DADRA1BUSP2KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0457195-B1 Peptides having endothelin antagonist activity, a process for preparation thereof and pharmaceutical compositions comprising the same FUJISAWA PHARMACEUTICAL CO (JP) 1998-04-15 EP disclosed
US-5656604-A HYPOTENSIVE AGENT; ENDOTHELIN ANTAGONIST FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-08-12 US disclosed
US-5430022-A Endothelin antagonists; hypotensive agents; treatment for angina pectoris, brain disorders, asthma, renal failure FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1995-07-04 US disclosed
US-5284828-A Hypotensive agents FUJISAWA PHARMACEUTICAL CO. LTD. (JP) 1994-02-08 US disclosed
EP-0457195-A2 Peptides having endothelin antagonist activity, a process for preparation thereof and pharmaceutical compositions comprising the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1991-11-21 EP disclosed