SCHEMBL8056249

SCHEMBL8056249

Fc1ccc2c(CCCN(c3ccncc3)c3csc4c(Cl)cccc34)noc2c1

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 14/20 0.38
DRD2 P14416 13/20 0.38
HTR7 P34969 13/20 0.38
HTR6 P50406 13/20 0.38
HTR1A P08908 1/20 0.33
HTR2C P28335 1/20 0.33
ADRA1B P35368 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
Hydrochloric Acid SCHEMBL8049912 0.99 HTR2A (0.37) HTR2ADRD2HTR7HTR6HTR1A
SCHEMBL8038919 0.87 HTR2A (0.38) HTR2ADRD2HTR7HTR6HTR1A
SCHEMBL8056700 0.84 DRD2 (0.39) HTR2ADRD2HTR7HTR6
Hydrochloric Acid SCHEMBL8054047 0.83 DRD2 (0.39) HTR2ADRD2HTR7HTR6
SCHEMBL8050574 0.77 CYP19A1 (0.32)
Hydrochloric Acid SCHEMBL8050310 0.76 CYP19A1 (0.31)
SCHEMBL8054066 0.75 DRD2 (0.37) HTR2ADRD2HTR7HTR1AHTR2C
Hydrochloric Acid SCHEMBL8056508 0.75 DRD2 (0.37) HTR2ADRD2HTR7HTR1AHTR2C
SCHEMBL8053626 0.74 SLC6A2 (0.39) HTR1A
Hydrochloric Acid SCHEMBL8051780 0.73 SLC6A2 (0.39) HTR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6022880-A Substituted pyridylamino indoles HOECHST MARION ROUSSEL, INC. (US) 2000-02-08 US disclosed
US-5328920-A Alleviating memory dysfunctions HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1994-07-12 US disclosed