SCHEMBL8490392

SCHEMBL8490392

CCOC(=O)N1CCC(N2CCC(=O)CC2)CC1

nearest known ligand 0.62

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 3/20 0.62
TP53 P04637 1/20 0.58
TDP1 Q9NUW8 1/20 0.58
MAPK1 P28482 1/20 0.58
L3MBTL1 Q9Y468 2/20 0.55
GAA P10253 2/20 0.54
SMN1; SMN2 Q16637 2/20 0.54
ALOX12 P18054 1/20 0.54
CHRM2 P08172 2/20 0.53
CHRM4 P08173 1/20 0.53
CHRM5 P08912 1/20 0.53
CHRM3 P20309 1/20 0.53
ALDH1A1 P00352 3/20 0.51
KDM4E B2RXH2 3/20 0.51
THRB P10828 1/20 0.48
ATM Q13315 1/20 0.48
TSHR P16473 1/20 0.47
PKM P14618 1/20 0.46

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
SCHEMBL13243426 0.91 CHRM1 (0.52) CHRM1TP53TDP1MAPK1L3MBTL1
SCHEMBL30121711 0.87 CHRM2 (0.50) CHRM1TP53TDP1MAPK1L3MBTL1
SCHEMBL158497 0.83 TSHR (0.55) TDP1L3MBTL1GAASMN1; SMN2ALDH1A1
SCHEMBL8487351 0.82 MAPK1 (0.56) CHRM1TP53TDP1MAPK1L3MBTL1
SCHEMBL12967015 0.82 MAPK1 (0.70) CHRM1TP53TDP1MAPK1L3MBTL1
Hydrochloric Acid SCHEMBL27776511 0.81 TSHR (0.53) TDP1L3MBTL1GAASMN1; SMN2ALDH1A1
SCHEMBL8353063 0.81 CHRM1 (0.70) CHRM1TP53TDP1MAPK1L3MBTL1
SCHEMBL3410150 0.80 MAPT (0.49) TP53MAPK1L3MBTL1SMN1; SMN2ALDH1A1
SCHEMBL13618163 0.80 ALDH1A1 (0.49) CHRM1SMN1; SMN2ALDH1A1KDM4E
SCHEMBL1134499 0.80 ALDH1A1 (0.49) CHRM1SMN1; SMN2ALDH1A1KDM4E

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
WO-1999032489-A1 MUSCARINIC AGENTS AND USE THEREOF TO TREAT GLAUCOMA, MYOPIA AND VARIOUS OTHER CONDITIONS ALCON LABORATORIES, INC. (US) 1999-07-01 WO disclosed
WO-1999032445-A1 OXIMINO-PIPERIDINE, -PYRROLIDINE AND -AZEPINE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS MUSCARINIC RECEPTOR (ANT-)AGONISTS ALCON LABORATORIES, INC. (US) 1999-07-01 WO disclosed