SCHEMBL16023977

SCHEMBL16023977

CN(C)CCC(=O)OCI

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
DNM1 Q05193 1/20 0.44
CHRM2 P08172 1/20 0.40
CHRM4 P08173 1/20 0.40
CHRM5 P08912 1/20 0.40
CHRM1 P11229 1/20 0.40
CHRNB2 P17787 1/20 0.40
CHRM3 P20309 1/20 0.40
CHRNA4 P43681 1/20 0.40
ADRA2A P08913 1/20 0.32
ADRA1A P35348 1/20 0.32
CA12 O43570 2/20 0.32
CA2 P00918 2/20 0.32
CA9 Q16790 2/20 0.32
CA3 P07451 1/20 0.32
CA4 P22748 1/20 0.32
CA6 P23280 1/20 0.32
CA5A P35218 1/20 0.32
CA7 P43166 1/20 0.32

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
SCHEMBL3903055 0.79 DNM1 (0.50) MEN1KMT2ADNM1CHRM2CHRM4
SCHEMBL11668491 0.79 DNM1 (0.66) MEN1KMT2ADNM1CHRM2CHRM4
SCHEMBL808668 0.77 MEN1 (0.41) MEN1KMT2ADNM1CHRM2CHRM4
SCHEMBL8788095 0.76 ALDH1A1 (0.41) MEN1KMT2ADNM1CHRM2CHRM4
SCHEMBL22460827 0.76 DNM1 (0.52) MEN1KMT2ADNM1CHRM2CHRM4
SCHEMBL16023900 0.76 DNM1 (0.61) MEN1KMT2ADNM1CHRM2CHRM4
SCHEMBL7245514 0.75 ALDH1A1 (0.50) MEN1KMT2ADNM1CHRM2CHRM4
Hydrochloric Acid SCHEMBL11841630 0.74 DNM1 (0.59) MEN1KMT2ADNM1CHRM2CHRM4
SCHEMBL19034536 0.74 MEN1 (0.42) MEN1KMT2ADNM1CHRM2CHRM4
SCHEMBL10081255 0.74 MEN1 (0.42) MEN1KMT2ADNM1CHRM2CHRM4

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
WO-2014136086-A1 LIPIDS AND LIPID COMPOSITIONS FOR THE DELIVERY OF ACTIVE AGENTS NOVARTIS AG (CH) 2014-09-12 WO disclosed