SCHEMBL1725948

SCHEMBL1725948

CCN(c1ccc(OC)c(N2CCN(C)CC2)c1)S(=O)(=O)c1cccc(OC(F)F)c1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 13/20 0.48
HTR1A P08908 3/20 0.48
HTR2A P28223 2/20 0.48
HTR2C P28335 2/20 0.48
HTR7 P34969 2/20 0.48
DRD3 P35462 2/20 0.48
KDM2B Q8NHM5 1/20 0.45
ESR1 P03372 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
ALDH1A1 P00352 1/20 0.40
GAA P10253 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
HTR1D P28221 1/20 0.40
HTR1B P28222 1/20 0.40

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 SCHEMBL1612055 0.99 HTR6 (0.47) HTR6HTR1AHTR2AHTR2CHTR7
SCHEMBL1726322 0.88 HTR6 (0.46) HTR6HTR1AHTR2AHTR2CHTR7
SCHEMBL1612196 0.88 HTT (0.41) KDM2BESR1MEN1KMT2AALDH1A1
Hydrochloric Acid SCHEMBL1611755 0.87 HTR6 (0.46) HTR6HTR1AHTR2AHTR2CHTR7
SCHEMBL1725822 0.83 HTR6 (0.46) HTR6KDM2B
SCHEMBL617277 0.83 ESR1 (0.46) HTR6ESR1
Hydrochloric Acid SCHEMBL1611764 0.83 HTR6 (0.46) HTR6KDM2B
Hydrochloric Acid SCHEMBL618220 0.82 HTR6 (0.46) HTR6ESR1
SCHEMBL615215 0.82 HTR6 (0.52) HTR6
SCHEMBL1613165 0.81 HTT (0.40) HTR6HTR1AHTR2AHTR2CHTR7

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
WO-2011163279-A3 LOW-POWER WIRELESSLY-LINKED RFID TRACKING SYSTEM ROSE MARK D (US) 2012-05-10 WO claimed
EP-2217583-B1 BENZENESULFONANILIDE COMPOUNDS SUITABLE FOR TREATING DISORDERS THAT RESPOND TO MODULATION OF THE SEROTONIN 5-HT6 RECEPTOR ABBOTT GMBH & CO KG (DE) 2011-11-30 EP claimed