SCHEMBL30360659

SCHEMBL30360659

CNC[C@H]1OCCc2c(C)cccc21

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 6/20 0.52
ADRA2A P08913 1/20 0.48
ADRA2B P18089 1/20 0.48
ADRA2C P18825 1/20 0.48
ADRA1D P25100 1/20 0.48
ADRA1A P35348 1/20 0.48
ADRA1B P35368 1/20 0.48
HTR1A P08908 1/20 0.44
DRD2 P14416 1/20 0.44
HTR7 P34969 1/20 0.44
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
DRD1 P21728 3/20 0.40
CYP2D6 P10635 6/20 0.39
SLC6A2 P23975 6/20 0.39
SLC6A4 P31645 6/20 0.39
SLC6A3 Q01959 3/20 0.38

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
SCHEMBL19812879 1.00 TAAR1 (0.52) TAAR1ADRA2AADRA2BADRA2CADRA1D
SCHEMBL32670726 1.00 TAAR1 (0.52) TAAR1ADRA2AADRA2BADRA2CADRA1D
SCHEMBL19812882 1.00 TAAR1 (0.52) TAAR1ADRA2AADRA2BADRA2CADRA1D
SCHEMBL19812933 1.00 TAAR1 (0.52) TAAR1ADRA2AADRA2BADRA2CADRA1D
SCHEMBL30360697 1.00 TAAR1 (0.52) TAAR1ADRA2AADRA2BADRA2CADRA1D
SCHEMBL19812976 0.87 TAAR1 (0.51) TAAR1ADRA2AADRA2BADRA2CADRA1D
SCHEMBL19813024 0.87 TAAR1 (0.51) TAAR1ADRA2AADRA2BADRA2CADRA1D
SCHEMBL21451736 0.87 DRD1 (0.39) TAAR1ADRA2AADRA2BADRA2CADRA1D
SCHEMBL32670585 0.87 TAAR1 (0.51) TAAR1ADRA2AADRA2BADRA2CADRA1D
SCHEMBL30360662 0.87 TAAR1 (0.51) TAAR1ADRA2AADRA2BADRA2CADRA1D

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116514761-A Compounds, compositions and uses thereof 赛诺维信制药公司 2023-08-01 CN disclosed
CN-116283877-A Compounds, compositions and uses thereof 赛诺维信制药公司 2023-06-23 CN disclosed
CN-110088107-B Compounds, compositions and uses thereof 赛诺维信制药公司 2023-04-14 CN disclosed