SCHEMBL21048892

SCHEMBL21048892

CCN(c1ccc(OC)cc1CNC(=O)O)S(=O)(=O)c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PTGER1 P34995 2/20 0.50
APOBEC3A P31941 1/20 0.48
APOBEC3G Q9HC16 1/20 0.48
KEAP1 Q14145 4/20 0.48
NFE2L2 Q16236 4/20 0.48
MAPT P10636 3/20 0.47
MMP1 P03956 1/20 0.47
MMP9 P14780 1/20 0.47
MMP13 P45452 1/20 0.47
USP2 O75604 1/20 0.46
HPGD P15428 1/20 0.46
ALOX15 P16050 1/20 0.46
TSHR P16473 1/20 0.46
MMP12 P39900 1/20 0.46
POLB P06746 1/20 0.46

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
SCHEMBL21048953 0.86 LMNA (0.53) PTGER1APOBEC3AAPOBEC3GKEAP1NFE2L2
SCHEMBL21048810 0.86 GAA (0.47) TSHRPOLB
SCHEMBL21048967 0.83 MAPT (0.51) PTGER1APOBEC3AAPOBEC3GKEAP1NFE2L2
Hydrochloric Acid SCHEMBL21048898 0.81 KEAP1 (0.46) KEAP1NFE2L2MAPTUSP2HPGD
SCHEMBL21048778 0.77 GAA (0.44) KEAP1NFE2L2MAPTHPGDTSHR
SCHEMBL21734725 0.76 KEAP1 (0.60) KEAP1NFE2L2MAPT
SCHEMBL17258875 0.76 KEAP1 (0.50) KEAP1NFE2L2MAPTHPGD
SCHEMBL21048817 0.74 PGR (0.54) PTGER1KEAP1NFE2L2MAPTHPGD
SCHEMBL16557608 0.74 KEAP1 (0.61) KEAP1NFE2L2MAPTHPGDPOLB
SCHEMBL15583912 0.71 MAPT (0.70) MAPTHPGDTSHRPOLB

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
EP-3143021-B1 PYRAZOLOPYRIDINES AND PYRAZOLOPYRIMIDINES PFIZER (US) 2019-06-12 EP disclosed