SCHEMBL22415944

SCHEMBL22415944

O=C(O)C1CCCC[C@H]1CN1C2CCC1CC2

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.47
CHRM4 P08173 1/20 0.47
CHRM5 P08912 1/20 0.47
CHRM1 P11229 1/20 0.47
PEPD P12955 1/20 0.36
MEN1 O00255 1/20 0.33
BLM P54132 1/20 0.33
KMT2A Q03164 1/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33

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
SCHEMBL22416019 1.00 CHRM2 (0.47) CHRM2CHRM4CHRM5CHRM1PEPD
SCHEMBL22415869 0.77 CHRM5 (0.42) CHRM5PEPDMEN1KMT2AALDH1A1
SCHEMBL22415855 0.77 CHRM5 (0.42) CHRM5PEPDMEN1KMT2AALDH1A1
SCHEMBL19576544 0.77 CHRM5 (0.42) CHRM5PEPDMEN1KMT2AALDH1A1
SCHEMBL19576793 0.76 CHRM5 (0.45) CHRM5PEPDMEN1KMT2AALDH1A1
SCHEMBL19576637 0.76 CHRM5 (0.45) CHRM5PEPDMEN1KMT2AALDH1A1
SCHEMBL6033629 0.73 KEAP1 (0.36)
SCHEMBL13761134 0.73 PEPD (0.42) PEPDMEN1BLMKMT2A
SCHEMBL7907529 0.73 PEPD (0.42) PEPDMEN1BLMKMT2A
SCHEMBL9376361 0.73 PEPD (0.42) PEPDMEN1BLMKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3452485-B1 ARGINASE INHIBITORS AND THEIR THERAPEUTIC APPLICATIONS ONCOARENDI THERAPEUTICS SA (PL) 2020-09-09 EP disclosed