SCHEMBL7093631

SCHEMBL7093631

C#CCc1noc2cc(F)ccc12

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ACHE P22303 2/20 0.39
DRD2 P14416 6/20 0.39
SLC6A4 P31645 1/20 0.39
HTR2A P28223 7/20 0.38
HTR7 P34969 6/20 0.38
HTR6 P50406 5/20 0.38
CHRNA7 P36544 1/20 0.36
HTR3A P46098 1/20 0.36
HTR1A P08908 1/20 0.35
HTR2C P28335 1/20 0.35
ADRA1B P35368 1/20 0.35

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
SCHEMBL24410388 0.78 DRD2 (0.47) ACHEDRD2SLC6A4HTR2AHTR7
SCHEMBL2774476 0.78 ACHE (0.42) ACHEDRD2SLC6A4HTR2AHTR7
SCHEMBL19141702 0.78 ACHE (0.42) ACHEDRD2SLC6A4HTR2AHTR7
SCHEMBL5450472 0.75 DRD2 (0.43) ACHEDRD2SLC6A4HTR2AHTR7
SCHEMBL19142287 0.74 MAPT (0.39) ACHEDRD2SLC6A4HTR2AHTR7
SCHEMBL8116328 0.73 MAPT (0.56) ACHEDRD2HTR2AHTR7HTR6
SCHEMBL8249064 0.73 DRD2 (0.47) DRD2SLC6A4HTR2AHTR7HTR6
SCHEMBL5407608 0.73 DRD2 (0.47) DRD2HTR2AHTR7HTR6
SCHEMBL15266105 0.73 HTR2A (0.47) DRD2HTR2AHTR7HTR6HTR1A
SCHEMBL7539608 0.73 DRD2 (0.47) DRD2HTR2AHTR7HTR6

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
EP-1015446-B1 (4-PIPERIDINYL)-1H-2-BENZOPYRAN DERIVATIVES USEFUL AS ANTIPSYCHOTIC AGENTS AVENTIS PHARMA INC (US) 2003-04-02 EP claimed