SCHEMBL24928545

SCHEMBL24928545

CC(=O)O[C@H]1CC[C@H](N)[C@@H]1N

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 5/20 0.41
CHRM1 P11229 3/20 0.41
CYP2D6 P10635 2/20 0.41
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
CHRM4 P08173 2/20 0.38
CHRM3 P20309 2/20 0.38
CYP2C19 P33261 1/20 0.33
NPSR1 Q6W5P4 1/20 0.32
SLC18A3 Q16572 1/20 0.30
GSR P00390 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
SCHEMBL30202204 1.00 CHRM2 (0.41) CHRM2CHRM1CYP2D6KMT2AMEN1
SCHEMBL16995324 0.74 CHRM2 (0.42) CHRM2CHRM1CYP2D6KMT2AMEN1
SCHEMBL1706303 0.74 CHRM2 (0.42) CHRM2CHRM1CYP2D6KMT2AMEN1
SCHEMBL8573060 0.74 CHRM2 (0.46) CHRM2CHRM1CYP2D6KMT2AMEN1
SCHEMBL9778994 0.74 CHRM2 (0.42) CHRM2CHRM1CYP2D6KMT2AMEN1
SCHEMBL11093585 0.74 CHRM2 (0.42) CHRM2CHRM1CYP2D6KMT2AMEN1
SCHEMBL22006156 0.72 CHRM2 (0.47) CHRM2CHRM1CYP2D6KMT2AMEN1
SCHEMBL17807032 0.72 CHRM2 (0.47) CHRM2CHRM1CYP2D6KMT2AMEN1
SCHEMBL28522654 0.72 CHRM2 (0.47) CHRM2CHRM1CYP2D6KMT2AMEN1
SCHEMBL13079825 0.72 CHRM2 (0.47) CHRM2CHRM1CYP2D6KMT2AMEN1

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-2023008470-A1 FUSED-RING AMINE DERIVATIVE 住友ファーマ株式会社 2023-02-02 WO disclosed