Ozone

Ozone

SCHEMBL7422852

CCOC(=O)c1cc(C=O)n(C)n1.O=[O+][O-]

nearest known ligand 0.39

Full drug profile on Sugi Atlas →

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.39
LMNA P02545 2/20 0.39
CYP1A2 P05177 1/20 0.39
FAAH O00519 2/20 0.38
NPC1 O15118 3/20 0.38
RAB9A P51151 3/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
MAPT P10636 2/20 0.38
GAA P10253 1/20 0.38
KMT2A Q03164 1/20 0.38
MMP2 P08253 1/20 0.37
MMP13 P45452 1/20 0.37
MMP14 P50281 1/20 0.37
MPO P05164 1/20 0.37
ADORA3 P0DMS8 1/20 0.36
CA9 Q16790 2/20 0.36
POLB P06746 1/20 0.36

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
SCHEMBL15300178 0.93 CYP1A2 (0.44) KDM4ELMNACYP1A2FAAHNPC1
SCHEMBL19897430 0.80 CYP1A2 (0.42) KDM4ELMNACYP1A2FAAHNPC1
SCHEMBL1233876 0.79 CYP1A2 (0.41) KDM4ELMNACYP1A2FAAHNPC1
SCHEMBL15784496 0.76 MAPK1 (0.39) KDM4ECYP1A2NPC1RAB9AKMT2A
SCHEMBL1233517 0.75 BAZ2B (0.54) KDM4ELMNACYP1A2FAAHNPC1
SCHEMBL15300116 0.74 KDM4E (0.46) KDM4ECYP1A2NPC1RAB9ASMN1; SMN2
SCHEMBL7426826 0.74 KDM4E (0.46) KDM4ECYP1A2NPC1RAB9ASMN1; SMN2
SCHEMBL7698241 0.73 LMNA (0.61) KDM4ELMNACYP1A2FAAHNPC1
SCHEMBL537688 0.73 CYP1A2 (0.47) KDM4ELMNACYP1A2FAAHNPC1
SCHEMBL15519242 0.72 CYP1A2 (0.46) KDM4ELMNACYP1A2FAAHNPC1

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-1003748-A2 PYRROLOPYRROLONE DERIVATIVES AS INHIBITORS OF NEUTROPHIL ELASTASE GLAXO GROUP LIMITED (GB) 2000-05-31 EP disclosed
WO-1999012933-A2 PYRROLOPYRROLONE DERIVATIVES AS INHIBITORS OF NEUTROPHIL ELASTASE GLAXO GROUP LIMITED (GB) 1999-03-18 WO disclosed