SCHEMBL9344897

SCHEMBL9344897

CC(NS(=O)(=O)c1ccc(Cl)c2ncccc12)N1CCN(CCCSc2ccccc2)CC1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 4/20 0.38
HTR2A P28223 3/20 0.38
DRD2 P14416 3/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
DRD1 P21728 2/20 0.38
DRD5 P21918 2/20 0.38
DRD3 P35462 2/20 0.38
PTK2 Q05397 1/20 0.38
LMNA P02545 1/20 0.38
MAPT P10636 1/20 0.38
KDM4E B2RXH2 3/20 0.37
ALDH1A1 P00352 3/20 0.37
POLB P06746 3/20 0.37
THRB P10828 1/20 0.37
HTR7 P34969 6/20 0.36
ADRA2C P18825 1/20 0.36
HRH1 P35367 1/20 0.36
HTR6 P50406 4/20 0.36
FTO Q9C0B1 1/20 0.35
GRIN2A Q12879 1/20 0.34

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 SCHEMBL9346268 0.99 PTK2 (0.38) HTR1AHTR2ADRD2SMN1; SMN2DRD1
SCHEMBL9345625 0.97 PTK2 (0.36) HTR1AHTR2ADRD2SMN1; SMN2DRD1
SCHEMBL9349805 0.88 SMN1; SMN2 (0.41) HTR1AHTR2ADRD2SMN1; SMN2DRD3
SCHEMBL9345574 0.86 FTO (0.40) HTR1AHTR2ASMN1; SMN2LMNAMAPT
SCHEMBL9344898 0.85 TSHR (0.46) HTR1AHTR2ADRD2DRD1DRD5
SCHEMBL9349897 0.85 SMN1; SMN2 (0.39) HTR1AHTR2ADRD2SMN1; SMN2DRD3
SCHEMBL9344868 0.85 MAPT (0.41) HTR1AHTR2ASMN1; SMN2LMNAMAPT
Hydrochloric Acid SCHEMBL9346272 0.84 TSHR (0.46) HTR1AHTR2ADRD2DRD1DRD5
SCHEMBL9345630 0.83 TSHR (0.48) HTR1AHTR2ADRD2KDM4EALDH1A1
SCHEMBL9349852 0.82 FTO (0.41) SMN1; SMN2LMNAMAPTKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-5001037-A None JP disclosed
US-5326870-A Asthma; bronchodilator agents; respiratory system disorders ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1994-07-05 US disclosed
EP-0525203-A1 SUBSTITUTED SULFONAMIDE DERIVATIVE OR PHARMACEUTICAL COMPOSITION CONTAINING THE SAME Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1993-02-03 EP disclosed
JP-H051037-A SUBSTITUTED SULFONAMIDE DERIVATIVE AND MEDICINAL COMPOSITION CONTAINING THE SAME DERIVATIVE ASAHI CHEM IND CO LTD 1993-01-08 JP disclosed