SCHEMBL4781205

SCHEMBL4781205

CN1C2CCC(C2)CC1CC(CO)(c1ccccc1)c1ccccc1

nearest known ligand 0.67

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 19/20 0.67
CHRM2 P08172 14/20 0.67
CHRM1 P11229 14/20 0.67
KDM4E B2RXH2 1/20 0.36
MEN1 O00255 1/20 0.36
LMNA P02545 1/20 0.36
POLB P06746 1/20 0.36
CHRM5 P08912 1/20 0.36
ADRA2C P18825 1/20 0.36
HTR2C P28335 1/20 0.36
ADRA1A P35348 1/20 0.36
HRH1 P35367 1/20 0.36
BLM P54132 1/20 0.36
KMT2A Q03164 1/20 0.36

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
SCHEMBL4644542 0.81 CHRM3 (0.72) CHRM3CHRM2CHRM1LMNA
SCHEMBL143799 0.81 CHRM3 (1.00) CHRM3CHRM2CHRM1
SCHEMBL143800 0.81 CHRM3 (1.00) CHRM3CHRM2CHRM1
SCHEMBL4779801 0.78 CHRM3 (0.74) CHRM3CHRM2CHRM1
SCHEMBL1009534 0.67 CHRM3 (0.74) CHRM3CHRM2CHRM1
SCHEMBL1009533 0.67 CHRM3 (0.74) CHRM3CHRM2CHRM1
SCHEMBL1009920 0.66 CHRM3 (1.00) CHRM3CHRM2CHRM1
SCHEMBL1009919 0.66 CHRM3 (1.00) CHRM3CHRM2CHRM1
SCHEMBL6703364 0.66 CHRM3 (0.38) CHRM3CHRM2CHRM1
SCHEMBL139738 0.65 CHRM3 (1.00) CHRM3CHRM2CHRM1

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
WO-2008000777-A2 PHENYL- PYRAZOLE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR PHARMACEUTICAL USE GLAXO GROUP LIMITED (GB) 2008-01-03 WO disclosed
EP-1802658-A2 CHIMERIC AND HUMANISED MONOCLONAL ANTIBODIES AGAINST INTERLEUKIN-13 GLAXO GROUP LIMITED (GB) 2007-07-04 EP disclosed
WO-2006003407-A2 CHIMERIC AND HUMANISED MONOCLONAL ANTIBODIES AGAINST INTELEUKIN- 13 GLAXO GROUP LIMITED (GB) 2006-01-12 WO disclosed