SCHEMBL6166888

SCHEMBL6166888

O=C(O)CNC1(C(=O)OCc2ccccc2)CC1

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DDB1 Q16531 1/20 0.48
CRBN Q96SW2 1/20 0.48
ALDH1A1 P00352 3/20 0.45
LMNA P02545 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
MAPK1 P28482 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
SLC6A2 P23975 1/20 0.44
SLC6A3 Q01959 1/20 0.44
KMT2A Q03164 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA9 Q16790 1/20 0.43
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
HTT P42858 1/20 0.42

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
SCHEMBL8296463 0.94 CTSL (0.47) DDB1CRBNALDH1A1LMNASMN1; SMN2
SCHEMBL7360632 0.93 CTSL (0.49) DDB1CRBNALDH1A1
SCHEMBL15114553 0.85 ALDH1A1 (0.49) DDB1CRBNALDH1A1LMNASMN1; SMN2
SCHEMBL15106342 0.81 ALDH1A1 (0.51) DDB1CRBNALDH1A1MAPK1L3MBTL1
SCHEMBL15125245 0.81 DDB1 (0.45) DDB1CRBNALDH1A1LMNASMN1; SMN2
SCHEMBL27032980 0.80 LMNA (0.47) DDB1CRBNALDH1A1LMNASMN1; SMN2
Hydrochloric Acid SCHEMBL30916058 0.80 ALDH1A1 (0.50) DDB1CRBNALDH1A1MAPK1L3MBTL1
SCHEMBL5592243 0.79 CTSB (0.45) DDB1CRBNALDH1A1
SCHEMBL7411019 0.77 CTSL (0.46) DDB1CRBNTDP1
SCHEMBL28369674 0.77 DDB1 (0.46) DDB1CRBNALDH1A1SMN1; SMN2MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1134219-B1 CYCLOALKYL-SUBSTITUTED AMINOMETHYLPYRROLIDINE DERIVATIVES DAIICHI SEIYAKU CO (JP) 2005-06-15 EP disclosed
US-6573260-B1 Antibiotics DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2003-06-03 US disclosed
EP-1134219-A1 CYCLOALKYL-SUBSTITUTED AMINOMETHYLPYRROLIDINE DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2001-09-19 EP disclosed