SCHEMBL6677154

SCHEMBL6677154

CCCOC(=O)c1ccccc1S(=O)(=O)N=[N+]=[N-]

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.56
TSHR P16473 7/20 0.47
TDP1 Q9NUW8 2/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
CYP3A4 P08684 2/20 0.46
MAPK1 P28482 2/20 0.46
TP53 P04637 1/20 0.46
LMNA P02545 2/20 0.44
HSD17B10 Q99714 3/20 0.42
PDK2 Q15119 1/20 0.41
KDM4E B2RXH2 3/20 0.40
POLB P06746 1/20 0.40
MAOB P27338 1/20 0.40
ELANE P08246 1/20 0.38
PRTN3 P24158 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA5A P35218 1/20 0.38
CA9 Q16790 1/20 0.38
STS P08842 1/20 0.37

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
SCHEMBL6678731 0.89 TSHR (0.54) ALDH1A1TSHRTDP1L3MBTL1CYP3A4
SCHEMBL8085524 0.85 ALDH1A1 (0.38) ALDH1A1TSHRTDP1L3MBTL1CYP3A4
SCHEMBL6684279 0.84 ALDH1A1 (0.42) ALDH1A1TSHRTDP1L3MBTL1CYP3A4
SCHEMBL11111735 0.80 ALDH1A1 (0.58) ALDH1A1TSHRTDP1L3MBTL1CYP3A4
SCHEMBL6684276 0.78 CA9 (0.35) ALDH1A1TSHRL3MBTL1LMNAKDM4E
SCHEMBL9729928 0.77 ALDH1A1 (0.67) ALDH1A1TSHRTDP1L3MBTL1CYP3A4
SCHEMBL8436890 0.77 ALDH1A1 (0.67) ALDH1A1TSHRTDP1L3MBTL1CYP3A4
SCHEMBL16047119 0.76 ALDH1A1 (0.65) ALDH1A1TSHRTDP1L3MBTL1CYP3A4
Potassium Ion SCHEMBL39638 0.76 ALDH1A1 (0.65) ALDH1A1TSHRTDP1L3MBTL1CYP3A4
SCHEMBL1556252 0.75 F2 (0.58) ALDH1A1TSHRKDM4EPOLBCA1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0878740-B1 Radiation sensitive polymer composition TORAY INDUSTRIES (JP) 2004-11-10 EP disclosed
US-6090525-A PHOTOSENSITIVE POLYIMIDE COATING AGENT COMPOSITION WITH BOTH GOOD VISCOSITY STABILITY AT ROOM TEMPERATURE WITH LAPSE OF TIME AND GOOD PHOTOSENSITIVE PERFORMANCE TORAY INDUSTRIES, INC. (JP) 2000-07-18 US disclosed
EP-0878740-A1 Radiation sensitive polymer composition TORAY INDUSTRIES, INC. (JP) 1998-11-18 EP disclosed