SCHEMBL29307154

SCHEMBL29307154

C=C(C)OCC1CCN(CC)CC1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.39
BCHE P06276 1/20 0.36
ACHE P22303 1/20 0.36
CHRM3 P20309 4/20 0.35
EPHX1 P07099 2/20 0.35
HRH3 Q9Y5N1 3/20 0.34
CARM1 Q86X55 1/20 0.34
PRMT6 Q96LA8 1/20 0.34
HTR2A P28223 1/20 0.34
HTR2C P28335 1/20 0.34
HTR2B P41595 1/20 0.34
EPHX2 P34913 1/20 0.33
CHRM2 P08172 1/20 0.33
CHRM4 P08173 1/20 0.33
CHRM5 P08912 1/20 0.33
CHRM1 P11229 1/20 0.33
HTR4 Q13639 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
SCHEMBL23675573 0.80 ALDH1A1 (0.33)
SCHEMBL19540992 0.80 ALDH1A1 (0.33)
SCHEMBL23675571 0.80 ALDH1A1 (0.33)
SCHEMBL28037383 0.76 SMN1; SMN2 (0.55) SMN1; SMN2BCHEACHECHRM3EPHX1
SCHEMBL12188159 0.74 SMN1; SMN2 (0.41) SMN1; SMN2EPHX1HRH3HTR2AHTR2C
SCHEMBL3230353 0.74 LMNA (0.46) EPHX1
SCHEMBL27268258 0.73 NCF1 (0.43) SMN1; SMN2CHRM3HRH3HTR2AHTR2C
SCHEMBL26331479 0.73 SMN1; SMN2 (0.46) SMN1; SMN2BCHEACHECHRM3EPHX1
SCHEMBL28647347 0.72 ESR1 (0.31)
SCHEMBL22309872 0.72 SMN1; SMN2 (0.39) SMN1; SMN2EPHX1HRH3HTR2AHTR2C

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-2024148060-A1 MK2 DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. (US) 2024-07-11 WO disclosed