SCHEMBL5808980

SCHEMBL5808980

Cc1csc(Sc2ccc(S(=O)(=O)NC(=O)Cc3cc(C)nn3-c3ccccc3)s2)n1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.43
MAPK1 P28482 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.39
MEN1 O00255 1/20 0.38
THRB P10828 1/20 0.38
KMT2A Q03164 1/20 0.38
GAA P10253 3/20 0.37
TSHR P16473 1/20 0.37
POLB P06746 2/20 0.36
PKM P14618 2/20 0.36
TDP1 Q9NUW8 1/20 0.36
ALDH1A1 P00352 7/20 0.36
RAB9A P51151 2/20 0.36
MAPT P10636 2/20 0.36
NTRK1 P04629 2/20 0.35
HTT P42858 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
ATM Q13315 1/20 0.34
L3MBTL1 Q9Y468 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
SCHEMBL5808471 0.90 LMNA (0.37) LMNAMAPK1SMN1; SMN2MEN1THRB
SCHEMBL5809123 0.88 NTRK1 (0.38) LMNASMN1; SMN2THRBKMT2AGAA
SCHEMBL8262663 0.85 NTRK1 (0.35) LMNATHRBKMT2AGAATSHR
SCHEMBL8262196 0.84 GUSB (0.44) LMNAMAPK1SMN1; SMN2MEN1KMT2A
Hydrochloric Acid SCHEMBL5808028 0.84 NTRK1 (0.35) LMNATHRBKMT2AGAATSHR
SCHEMBL5804860 0.84 ALDH1A1 (0.42) LMNASMN1; SMN2MEN1THRBKMT2A
SCHEMBL5821042 0.84 MAPK13 (0.43) LMNAMAPK1SMN1; SMN2MEN1THRB
SCHEMBL5806376 0.84 NTRK1 (0.37) LMNASMN1; SMN2THRBKMT2AGAA
SCHEMBL5806305 0.83 LMNA (0.43) LMNAMAPK1SMN1; SMN2MEN1THRB
SCHEMBL5804805 0.83 MAPT (0.40) LMNAMAPK1SMN1; SMN2MEN1THRB

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-2006075955-A1 PYRAZOLYL ACYLSULFONAMIDE DERIVATIVES AS ENDOTHELIN CONVERTING ENZYME INHIBITORS AND USEFUL IN THE TREATMENT OF CHRONIC OBSTRUCTIVE PULMONARY DISEASE ASTRAZENECA AB (SE) 2006-07-20 WO disclosed
WO-2006075955-A1 PYRAZOLYL ACYLSULFONAMIDE DERIVATIVES AS ENDOTHELIN CONVERTING ENZYME INHIBITORS AND USEFUL IN THE TREATMENT OF CHRONIC OBSTRUCTIVE PULMONARY DISEASE ASTRAZENECA AB (SE) 2006-07-20 WO disclosed