SCHEMBL25081887

SCHEMBL25081887

CC(C)N1CCOC(CF)CC1

nearest known ligand 0.40

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 7/20 0.40
CHRM2 P08172 1/20 0.32
HTR1A P08908 1/20 0.32
DRD3 P35462 1/20 0.32
HTR2B P41595 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
SCHEMBL25081770 0.83 HRH3 (0.41) HRH3CHRM2HTR1ADRD3HTR2B
SCHEMBL25808277 0.83 HRH3 (0.51) HRH3CHRM2HTR1ADRD3HTR2B
SCHEMBL25808276 0.83 HRH3 (0.51) HRH3CHRM2HTR1ADRD3HTR2B
SCHEMBL25081867 0.81 HRH3 (0.40) HRH3
SCHEMBL26938051 0.79 HRH3 (0.44) HRH3
SCHEMBL26938041 0.79 HRH3 (0.38) HRH3
SCHEMBL26938053 0.79 HRH3 (0.44) HRH3
SCHEMBL26938042 0.79 HRH3 (0.44) HRH3
SCHEMBL26938032 0.78 HRH3 (0.42) HRH3
SCHEMBL25081823 0.77 HRH3 (0.38) HRH3

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-2023020519-A1 1, 4-OXAZEPANE DERIVATIVES AND USES THEREOF JACOBIO PHARMACEUTICALS CO., LTD. (CN) 2023-02-23 WO disclosed