SCHEMBL6983368

SCHEMBL6983368

COc1cc(-c2ccc(S(=O)(=O)c3ccccc3)nn2)n(-c2ccccc2)n1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.38
ALDH1A1 P00352 2/20 0.38
NPSR1 Q6W5P4 2/20 0.38
HTT P42858 1/20 0.38
TP53 P04637 1/20 0.37
POLB P06746 2/20 0.36
MAPT P10636 2/20 0.36
ATM Q13315 1/20 0.36
HPGD P15428 1/20 0.35
PIK3CA P42336 1/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
TSHR P16473 1/20 0.35
AURKA O14965 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
ALOX5 P09917 1/20 0.34
NR1I2 O75469 1/20 0.34
PTGS2 P35354 2/20 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
SCHEMBL27343295 0.75 CYP2C9 (0.45) LMNANPSR1TP53POLBTSHR
SCHEMBL7369553 0.75 HTT (0.47) LMNAALDH1A1NPSR1HTTPOLB
SCHEMBL6985834 0.74 ALDH1A1 (0.51) LMNAALDH1A1NPSR1HTTTP53
SCHEMBL6989453 0.72 KMT2A (0.42) LMNAALDH1A1NPSR1HTTMAPT
SCHEMBL7370147 0.71 PTGS1 (0.38) LMNAALDH1A1NPSR1HTTHPGD
SCHEMBL6979697 0.71 CYP1A2 (0.44) LMNAALDH1A1HTTTP53POLB
SCHEMBL7370829 0.70 NR3C2 (0.44) ALDH1A1NPSR1TP53POLBMAPT
SCHEMBL6986812 0.69 ALDH1A1 (0.40) LMNAALDH1A1NPSR1HTTMAPT
SCHEMBL6341690 0.68 PTGS2 (0.70) CYP2C9PTGS2PTGS1
SCHEMBL7366842 0.68 NR3C2 (0.43) LMNANPSR1TP53POLBMAPT

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
EP-1313733-A1 PYRAZOLOPYRIDINE COMPOUND AND PHARMACEUTICAL USE THEREOF FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2003-05-28 EP disclosed
WO-2002018382-A1 PYRAZOLOPYRIDINE COMPOUND AND PHARMACEUTICAL USE THEREOF FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-03-07 WO disclosed