SCHEMBL9297952

SCHEMBL9297952

COC(=O)C1CCCN1OC(C)=O

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.44
FKBP1A P62942 3/20 0.39
TP53 P04637 1/20 0.39
MMP2 P08253 2/20 0.38
ANPEP P15144 2/20 0.38
PEPD P12955 2/20 0.37
XPNPEP1 Q9NQW7 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
LTA4H P09960 2/20 0.35
ALOX5 P09917 1/20 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
SCHEMBL9297953 1.00 POLB (0.44) POLBFKBP1ATP53MMP2ANPEP
SCHEMBL28530158 0.95 FKBP1A (0.44) POLBFKBP1ATP53MMP2ANPEP
SCHEMBL28084825 0.83 POLB (0.40) POLBFKBP1AMMP2ANPEPPEPD
SCHEMBL30675399 0.83 POLB (0.47) POLBFKBP1APEPDXPNPEP1SMN1; SMN2
SCHEMBL27413439 0.82 ALDH1A1 (0.53) POLBMMP2ANPEPALOX5
SCHEMBL27682627 0.81 RAB9A (0.41) PEPDSMN1; SMN2LTA4H
SCHEMBL31205705 0.81 RAB9A (0.41) PEPDSMN1; SMN2LTA4H
Hydrochloric Acid SCHEMBL5204730 0.80 POLB (0.45) POLBFKBP1ATP53PEPDXPNPEP1
SCHEMBL1307458 0.80 GAA (0.32) SMN1; SMN2
Hydrochloric Acid SCHEMBL5204734 0.80 POLB (0.45) POLBFKBP1ATP53PEPDXPNPEP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0618810-A4 BRADYKININ ANTAGONIST PEPTIDES. SCIOS NOVA INC (US) 1994-12-07 EP disclosed
EP-0618810-A1 BRADYKININ ANTAGONIST PEPTIDES SCIOS NOVA INC. (US) 1994-10-12 EP disclosed