SCHEMBL9345625

SCHEMBL9345625

CC(NS(=O)(=O)c1ccc(Cl)c2ncccc12)N1CCCN(CCCSc2ccccc2)CC1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTK2 Q05397 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
LMNA P02545 1/20 0.36
MAPT P10636 1/20 0.36
HTR1A P08908 4/20 0.36
HTR2A P28223 3/20 0.36
DRD2 P14416 3/20 0.36
DRD1 P21728 2/20 0.36
DRD5 P21918 2/20 0.36
DRD3 P35462 2/20 0.36
KDM4E B2RXH2 4/20 0.35
ALDH1A1 P00352 2/20 0.35
TDP1 Q9NUW8 1/20 0.35
POLB P06746 2/20 0.35
THRB P10828 1/20 0.35
HTR7 P34969 5/20 0.35
ADRA2C P18825 1/20 0.35
HRH1 P35367 1/20 0.35
HTR6 P50406 5/20 0.34
TMEM97 Q5BJF2 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
SCHEMBL9344897 0.97 HTR1A (0.38) PTK2SMN1; SMN2LMNAMAPTHTR1A
Hydrochloric Acid SCHEMBL9346268 0.96 PTK2 (0.38) PTK2SMN1; SMN2LMNAMAPTHTR1A
SCHEMBL9349897 0.89 SMN1; SMN2 (0.39) SMN1; SMN2LMNAMAPTHTR1AHTR2A
SCHEMBL9345630 0.85 TSHR (0.48) HTR1AHTR2ADRD2KDM4EALDH1A1
SCHEMBL9349805 0.85 SMN1; SMN2 (0.41) SMN1; SMN2LMNAMAPTHTR1AHTR2A
SCHEMBL9344884 0.84 HRH3 (0.40) DRD2ALDH1A1HRH1
SCHEMBL9346842 0.84 HRH3 (0.40) LMNAMAPTDRD2ALDH1A1POLB
SCHEMBL9344861 0.84 HTR1A (0.44) LMNAHTR1AHTR2ADRD2DRD1
SCHEMBL9345574 0.83 FTO (0.40) SMN1; SMN2LMNAMAPTHTR1AHTR2A
SCHEMBL9344898 0.83 TSHR (0.46) HTR1AHTR2ADRD2DRD1DRD5

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-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