SCHEMBL30360680

SCHEMBL30360680

CNC[C@H]1OCCc2ccc(F)cc21

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 6/20 0.55
HTR1A P08908 2/20 0.50
DRD2 P14416 2/20 0.50
HTR7 P34969 1/20 0.50
HTR2A P28223 4/20 0.43
HTR2C P28335 3/20 0.43
HTR2B P41595 2/20 0.43
SLC6A2 P23975 2/20 0.40
SLC6A4 P31645 2/20 0.40
ALDH1A1 P00352 2/20 0.39
LMNA P02545 1/20 0.39
KMT2A Q03164 1/20 0.39
GAA P10253 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
TSHR P16473 1/20 0.38
RECQL P46063 1/20 0.38
ADRA2A P08913 2/20 0.38
ADRA2B P18089 2/20 0.38
ADRA2C P18825 2/20 0.38
ADRA1D P25100 2/20 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
SCHEMBL19812867 1.00 TAAR1 (0.55) TAAR1HTR1ADRD2HTR7HTR2A
SCHEMBL30360664 1.00 TAAR1 (0.55) TAAR1HTR1ADRD2HTR7HTR2A
SCHEMBL19812798 1.00 TAAR1 (0.55) TAAR1HTR1ADRD2HTR7HTR2A
SCHEMBL32670755 1.00 TAAR1 (0.55) TAAR1HTR1ADRD2HTR7HTR2A
SCHEMBL19812796 1.00 TAAR1 (0.55) TAAR1HTR1ADRD2HTR7HTR2A
SCHEMBL19812820 0.88 TAAR1 (0.55) TAAR1HTR1ADRD2HTR7HTR2A
SCHEMBL19812818 0.88 TAAR1 (0.55) TAAR1HTR1ADRD2HTR7HTR2A
SCHEMBL19813091 0.88 TAAR1 (0.55) TAAR1HTR1ADRD2HTR7HTR2A
SCHEMBL19821145 0.84 TAAR1 (0.56) TAAR1HTR1ADRD2HTR7ALDH1A1
SCHEMBL19821146 0.84 TAAR1 (0.56) TAAR1HTR1ADRD2HTR7ALDH1A1

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-110088107-B Compounds, compositions and uses thereof 赛诺维信制药公司 2023-04-14 CN disclosed