SCHEMBL8920652

SCHEMBL8920652

CCc1sc2c(c1C(=O)CCCN1CCC(c3noc4cc(F)ccc34)CC1)CCN(C(C)=O)C2

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 7/20 0.53
HTR2A P28223 5/20 0.53
HTR1A P08908 3/20 0.53
HTR2C P28335 2/20 0.53
ADRA1A P35348 2/20 0.53
HRH1 P35367 2/20 0.53
HTR6 P50406 2/20 0.53
KCNH2 Q12809 2/20 0.53
DRD3 P35462 1/20 0.53
SLC6A4 P31645 1/20 0.52
ADRA2A P08913 1/20 0.52
ADRA1D P25100 1/20 0.52
ADRA1B P35368 1/20 0.52
HTR7 P34969 2/20 0.51

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
SCHEMBL8916453 0.93 DRD2 (0.54) DRD2HTR2AHTR1AHTR2CADRA1A
SCHEMBL8917880 0.88 DRD2 (0.53) DRD2HTR2AHTR1AHTR2CADRA1A
SCHEMBL8920271 0.88 DRD2 (0.56) DRD2HTR2AHTR1AHTR2CADRA1A
SCHEMBL8918298 0.87 DRD2 (0.54) DRD2HTR2AHTR1AHTR2CADRA1A
SCHEMBL8917237 0.87 DRD2 (0.53) DRD2HTR2AHTR1AHTR2CADRA1A
SCHEMBL8918089 0.86 DRD2 (0.54) DRD2HTR2AHTR1AHTR2CADRA1A
SCHEMBL8918296 0.85 MCHR1 (0.62) DRD2HTR2AHTR1AHTR2CADRA1A
SCHEMBL8916632 0.84 DRD2 (0.54) DRD2HTR2AHTR1AHTR2CADRA1A
SCHEMBL8918706 0.84 DRD2 (0.56) DRD2HTR2AHTR1AHTR2CADRA1A
SCHEMBL8918155 0.84 DRD2 (0.53) DRD2HTR2AHTR1AHTR2CADRA1A

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
US-5691330-A ANTIPSYCHOTIC AGENT YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1997-11-25 US disclosed
US-5532240-A ANTIPSYCHOTIC AGENTS AND ANTISEROTONIN AGENTS YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1996-07-02 US disclosed
EP-0596125-A1 CONDENSED THIOPHENE COMPOUND AND PHARMACEUTICAL USE THEREOF YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1994-05-11 EP disclosed