SCHEMBL4660967

SCHEMBL4660967

CC(C)(C)N(C(=O)O)C1CCN(C2CCC(OCC3CC3)CC2)CC1

nearest known ligand 0.33

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 6/20 0.33
LPL P06858 1/20 0.32
LIPG Q9Y5X9 1/20 0.32
KDM4E B2RXH2 2/20 0.32
ALDH1A1 P00352 2/20 0.32
ALOX15 P16050 1/20 0.32
POLB P06746 1/20 0.32
TP53 P04637 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
ADRA1A P35348 1/20 0.31
CHRM1 P11229 1/20 0.30
BCHE P06276 1/20 0.30

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
SCHEMBL600684 0.88 CHRM1 (0.35) KDM4EALDH1A1ALOX15POLBTP53
SCHEMBL600683 0.88 CHRM1 (0.35) KDM4EALDH1A1ALOX15POLBTP53
SCHEMBL601629 0.88 CHRM1 (0.35) KDM4EALDH1A1ALOX15POLBTP53
SCHEMBL600638 0.85 TAAR1 (0.35) KDM4EALDH1A1ALOX15POLBTP53
SCHEMBL600637 0.85 TAAR1 (0.35) KDM4EALDH1A1ALOX15POLBTP53
SCHEMBL601803 0.85 TAAR1 (0.35) KDM4EALDH1A1ALOX15POLBTP53
SCHEMBL1306189 0.84 ALDH1A1 (0.35) KDM4EALDH1A1ALOX15POLBMEN1
SCHEMBL4660815 0.83 CHRM1 (0.32) CHRM1BCHE
SCHEMBL600511 0.83 ACACB (0.32) KDM4EALDH1A1MEN1KMT2ACHRM1
SCHEMBL602320 0.80 SIGMAR1 (0.32)

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-2004182-A1 BENZIMIDAZOLES WHICH HAVE ACTIVITY AT M1 RECEPTOR AND THEIR USES IN MEDICINE GLAXO GROUP LIMITED (GB) 2008-12-24 EP disclosed
WO-2007107565-A1 BENZIMIDAZOLES WHICH HAVE ACTIVITY AT M1 RECEPTOR AND THEIR USES IN MEDICINE GLAXO GROUP LIMITED (GB) 2007-09-27 WO disclosed