SCHEMBL28202604

SCHEMBL28202604

[CH2][C@@H]1CC=CCN1C(=O)OC(C)(C)C

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.42
CHRM1 P11229 1/20 0.42
CHRM3 P20309 1/20 0.42
PREP P48147 1/20 0.40
USP2 O75604 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
CTSK P43235 1/20 0.34
HSD17B10 Q99714 1/20 0.34
KDM4E B2RXH2 1/20 0.34
MAPT P10636 1/20 0.34
THRB P10828 1/20 0.34
MAPK1 P28482 1/20 0.34
LMNA P02545 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
NR1H2 P55055 1/20 0.33
CYP1A2 P05177 1/20 0.33
POLB P06746 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C19 P33261 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
SCHEMBL30477339 0.81 PREP (0.41) CHRM2CHRM1CHRM3PREPUSP2
SCHEMBL26765821 0.81 PREP (0.41) CHRM2CHRM1CHRM3PREPUSP2
SCHEMBL16824591 0.79 HSD17B10 (0.42) CHRM2CHRM1CHRM3PREPUSP2
SCHEMBL610128 0.79 HSD17B10 (0.42) CHRM2CHRM1CHRM3PREPUSP2
SCHEMBL16824590 0.79 HSD17B10 (0.42) CHRM2CHRM1CHRM3PREPUSP2
SCHEMBL30627141 0.78 PREP (0.39) CHRM2CHRM1CHRM3PREPUSP2
SCHEMBL609920 0.78 NR1H2 (0.41) CHRM2CHRM1CHRM3PREPCTSK
SCHEMBL4898628 0.77 CHRM2 (0.46) CHRM2CHRM1CHRM3PREPUSP2
SCHEMBL4891486 0.77 CHRM2 (0.46) CHRM2CHRM1CHRM3PREPUSP2
SCHEMBL4898643 0.77 CHRM2 (0.46) CHRM2CHRM1CHRM3PREPUSP2

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
CN-105793242-B Phenoxyethyl cyclic amine derivatives and their activity as EP4 receptor modulators 伊莱利利公司 2018-02-16 CN disclosed