SCHEMBL9546469

SCHEMBL9546469

COC(=O)C1CCCN1C(=O)OC

nearest known ligand 0.58

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.58
FKBP1A P62942 2/20 0.51
PEPD P12955 2/20 0.48
XPNPEP1 Q9NQW7 1/20 0.48
RAB9A P51151 2/20 0.45
ALOX5 P09917 1/20 0.45
TSHR P16473 1/20 0.44
ALDH1A1 P00352 3/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
LMNA P02545 1/20 0.43
PKM P14618 1/20 0.43
GAA P10253 1/20 0.41
CNR2 P34972 1/20 0.41

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
SCHEMBL30599979 1.00 POLB (0.58) POLBFKBP1APEPDXPNPEP1RAB9A
SCHEMBL70309 0.94 FKBP1A (0.57) POLBFKBP1APEPDXPNPEP1RAB9A
SCHEMBL3009795 0.86 FKBP1A (0.54) POLBFKBP1APEPDXPNPEP1RAB9A
SCHEMBL3009794 0.86 FKBP1A (0.54) POLBFKBP1APEPDXPNPEP1RAB9A
SCHEMBL5499151 0.86 FKBP1A (0.54) POLBFKBP1APEPDXPNPEP1RAB9A
SCHEMBL468720 0.85 POLB (0.58) POLBFKBP1APEPDXPNPEP1RAB9A
SCHEMBL9533366 0.85 POLB (0.62) POLBFKBP1APEPDXPNPEP1RAB9A
SCHEMBL13864545 0.85 RAB9A (0.45) POLBFKBP1ARAB9ATSHRALDH1A1
SCHEMBL14426613 0.85 POLB (0.58) POLBFKBP1APEPDXPNPEP1RAB9A
SCHEMBL2037827 0.85 POLB (0.58) POLBFKBP1APEPDXPNPEP1RAB9A

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
WO-1993023404-A1 COMPOUNDS THAT MODULATE ENDOTHELIN ACTIVITY IMMUNOPHARMACEUTICS, INC. (US) 1993-11-25 WO disclosed
EP-0327155-A2 Pyrazines, pyrimidines and pyridazines, useful in the treatment of senile dementia MERCK SHARP & DOHME LTD. (GB) 1989-08-09 EP disclosed
EP-0323864-A2 Lipophilic oxadiazoles MERCK SHARP & DOHME LTD. (GB) 1989-07-12 EP disclosed
EP-0307140-A1 Oxadiazolyl-azabicycloheptanes for the treatment of senile dementia MERCK SHARP & DOHME LTD. (GB) 1989-03-15 EP disclosed