SCHEMBL7948151

SCHEMBL7948151

CC(=O)N1c2ccc(S(C)(=O)=O)cc2N(C)S1(O)O

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.36
ENPP2 Q13822 1/20 0.34
BRD4 O60885 2/20 0.34
AKR1C3 P42330 2/20 0.33
AKR1C2 P52895 2/20 0.33
SLC6A9 P48067 1/20 0.33
DRD2 P14416 2/20 0.33
HRH1 P35367 2/20 0.33
DRD3 P35462 1/20 0.32
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32
KIF18A Q8NI77 1/20 0.32

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
SCHEMBL7948146 0.72 PTGS2 (0.32) LMNAENPP2BRD4DRD2HRH1
SCHEMBL6527031 0.72 ALDH1A1 (0.38) LMNABRD4AKR1C3AKR1C2SLC6A9
SCHEMBL7821251 0.68 ENPP2 (0.35) LMNAENPP2BRD4
SCHEMBL6980884 0.64 BRD4 (0.31) BRD4
SCHEMBL14089194 0.64 NOTUM (0.63) LMNAALDH1A1
SCHEMBL21172742 0.62 BRD4 (0.40) LMNABRD4ALDH1A1
SCHEMBL28498255 0.61 NOX1 (0.67) LMNADRD2HRH1DRD3MAPT
SCHEMBL18217887 0.60 LMNA (0.55) LMNAENPP2AKR1C3AKR1C2ALDH1A1
SCHEMBL21729633 0.60 NOTUM (0.55) SLC6A9
SCHEMBL4035842 0.58 PNMT (0.49) LMNABRD4ALDH1A1

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
US-6329366-B1 HETEROCYCLIC, PIPERIDINE, INDOLE DERIVITIVES FOR TREATMENT OF NERVOUS SYSTEM DISORDERS AND SEROTONIN ANTAGONIST ELI LILLY AND COMPANY LIMITED (GB) 2001-12-11 US disclosed