SCHEMBL8621133

SCHEMBL8621133

CS(=O)(=O)c1cccnc1-c1cccnc1-c1ccccn1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 3/20 0.47
PTGS1 P23219 2/20 0.47
JAK1 P23458 2/20 0.42
TYK2 P29597 2/20 0.42
PTPRC P08575 2/20 0.42
CTSL P07711 1/20 0.42
CTSS P25774 1/20 0.42
PTPN13 Q12923 1/20 0.42
BLM P54132 2/20 0.42
TDP2 O95551 1/20 0.42
NSD2 O96028 1/20 0.42
ABL1 P00519 1/20 0.42
PLCG1 P19174 1/20 0.42
CES1 P23141 1/20 0.42
PAX8 Q06710 1/20 0.42
RIN1 Q13671 1/20 0.42
MEN1 O00255 1/20 0.42
THRB P10828 1/20 0.42
KMT2A Q03164 1/20 0.42
TDP1 Q9NUW8 1/20 0.42

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
SCHEMBL1205852 0.82 EDNRA (0.52) PTGS2PTGS1JAK1TYK2BLM
SCHEMBL7175144 0.79 PTGS2 (0.74) PTGS2PTGS1
SCHEMBL8621130 0.78 PTGS2 (0.43) PTGS2PTGS1JAK1TYK2BLM
SCHEMBL2201433 0.77 ALDH1A1 (0.46) PTGS2PTGS1KDM4ELMNAPOLB
SCHEMBL31365059 0.76 KDM4E (0.52) PTPRCCTSLCTSSPTPN13BLM
Ethane SCHEMBL28441646 0.76 KDM4E (0.52) PTPRCCTSLCTSSPTPN13BLM
SCHEMBL31635941 0.76 KDM4E (0.52) PTPRCCTSLCTSSPTPN13BLM
SCHEMBL29648219 0.76 KDM4E (0.52) PTPRCCTSLCTSSPTPN13BLM
SCHEMBL29539491 0.76 KDM4E (0.52) PTPRCCTSLCTSSPTPN13BLM
SCHEMBL5595486 0.76 KDM4E (0.52) PTPRCCTSLCTSSPTPN13BLM

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-0576036-B1 Optical information recording element using AZO dyes EASTMAN KODAK CO (US) 1998-05-20 EP disclosed
EP-0576036-A2 Optical information recording element using AZO dyes EASTMAN KODAK COMPANY (US) 1993-12-29 EP disclosed
US-5272047-A Optical information recording medium using azo dyes EASTMAN KODAK COMPANY (US) 1993-12-21 US disclosed