SCHEMBL21837249

SCHEMBL21837249

CO/N=C(\C)C1CCN(C2CCCN(C(=O)O)CC2)CC1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 3/20 0.41
CCR5 P51681 1/20 0.39
L3MBTL3 Q96JM7 3/20 0.39
L3MBTL1 Q9Y468 3/20 0.39
LMNA P02545 2/20 0.36
PKM P14618 1/20 0.35
CHRM2 P08172 2/20 0.35
CHRM4 P08173 2/20 0.35
TP53 P04637 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
ALDH1A1 P00352 1/20 0.34
MEN1 O00255 3/20 0.34
KMT2A Q03164 3/20 0.34
MAPT P10636 1/20 0.33
CHRM3 P20309 1/20 0.33

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
SCHEMBL18825157 1.00 CHRM1 (0.41) CHRM1CCR5L3MBTL3L3MBTL1LMNA
SCHEMBL21837251 1.00 CHRM1 (0.41) CHRM1CCR5L3MBTL3L3MBTL1LMNA
SCHEMBL18825156 1.00 CHRM1 (0.41) CHRM1CCR5L3MBTL3L3MBTL1LMNA
SCHEMBL21837274 0.86 CHRM1 (0.39) CHRM1L3MBTL3L3MBTL1LMNACHRM2
SCHEMBL21837257 0.86 CHRM1 (0.46) CHRM1L3MBTL3L3MBTL1LMNACHRM2
SCHEMBL21837272 0.86 CHRM1 (0.39) CHRM1L3MBTL3L3MBTL1LMNACHRM2
SCHEMBL21837254 0.86 CHRM1 (0.46) CHRM1L3MBTL3L3MBTL1LMNACHRM2
SCHEMBL28225559 0.86 CHRM1 (0.40) CHRM1CCR5L3MBTL3L3MBTL1LMNA
SCHEMBL18825096 0.85 CHRM1 (0.60) CHRM1PKMCHRM2CHRM4TP53
SCHEMBL18849557 0.85 CHRM1 (0.60) CHRM1PKMCHRM2CHRM4TP53

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
EP-3370828-B1 OXIME COMPOUNDS AS AGONISTS OF THE MUSCARINIC M1 AND/OR M4 RECEPTOR HEPTARES THERAPEUTICS LTD (GB) 2020-04-15 EP claimed