SCHEMBL8865951

SCHEMBL8865951

COC(C)N1C(=O)CCC1=O

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.35
CHRM4 P08173 1/20 0.35
CHRM5 P08912 1/20 0.35
CHRM1 P11229 1/20 0.35
CHRM3 P20309 1/20 0.35
KMT2A Q03164 1/20 0.34
ATM Q13315 1/20 0.34
POLB P06746 2/20 0.33
SLC1A2 P43004 1/20 0.32
PIK3CD O00329 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL8024903 0.82 CHRM2 (0.36) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL406639 0.78 CHRM2 (0.34) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL4923753 0.76 MAPT (0.31)
SCHEMBL8865252 0.75 CHRM2 (0.36) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL10903416 0.75 CHRM2 (0.36) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL1698550 0.73 SMN1; SMN2 (0.41) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL10644061 0.70 CHRM2 (0.38) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL9891112 0.70 NPC1 (0.35) PIK3CDSMN1; SMN2
SCHEMBL21243694 0.69 HCAR2 (0.43) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL1536266 0.69 CHRM2 (0.37) CHRM2CHRM4CHRM5CHRM1CHRM3

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
US-5700946-A ONE STEP CATALYTIC DEHYDROGENATION PROCESS OF N-(1-ALKOXYALKYL) COMPOUND NIPPON SHOKUBAI CO., LTD. (JP) 1997-12-23 US disclosed