SCHEMBL11207618

SCHEMBL11207618

COc1cc2nc(C)c(C)nc2cc1OCCS(=O)(=O)O

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NQO2 P16083 1/20 0.39
PGK1 P00558 2/20 0.38
ENPP1 P22413 3/20 0.37
PDE4B Q07343 2/20 0.36
EHMT2 Q96KQ7 2/20 0.36
EHMT1 Q9H9B1 2/20 0.36
SLC10A2 Q12908 1/20 0.36
STING1 Q86WV6 1/20 0.35
TNF P01375 1/20 0.35
PDGFRB P09619 2/20 0.35
PDGFRA P16234 2/20 0.35
PDE3B Q13370 2/20 0.35
PDE3A Q14432 2/20 0.35
TLR7 Q9NYK1 1/20 0.35
TXNRD1 Q16881 1/20 0.35
TXNRD3 Q86VQ6 1/20 0.35
TXNRD2 Q9NNW7 1/20 0.35

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
SCHEMBL11203741 0.93 ENPP1 (0.38) NQO2PGK1ENPP1EHMT2EHMT1
SCHEMBL11239999 0.80 KDM4E (0.41) ENPP1PDE4BEHMT2EHMT1SLC10A2
SCHEMBL11204028 0.79 TDP1 (0.35) PDE3A
SCHEMBL11207779 0.78 NQO2 (0.43) NQO2PGK1ENPP1EHMT2EHMT1
SCHEMBL346704 0.76 NQO2 (0.60) NQO2PGK1PDGFRBPDGFRAPDE3B
SCHEMBL11209776 0.75 NQO2 (0.41) NQO2PGK1ENPP1PDE4BSLC10A2
SCHEMBL11240736 0.75 ALDH1A1 (0.45) TXNRD1
SCHEMBL11231612 0.72 KDM4E (0.40) ENPP1EHMT2EHMT1SLC10A2
SCHEMBL11245175 0.71 HTR4 (0.40) ENPP1EHMT2EHMT1SLC10A2
SCHEMBL11231556 0.70 MAPT (0.41)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0014688-B1 PROCESS FOR THE TREATMENT OF SILVER DYE-BLEACHING MATERIALS, AQUEOUS PREPARATION THEREFOR, CONCENTRATE AND PROCESS FOR MAKING THE PREPARATION CIBA-GEIGY AG (CH) 1983-03-23 EP claimed
US-4304846-A USING MIXTURES OF A 1,4- OR 1,2-DIAZINE AS BLEACHING CATALYSTS; PREFERENTIAL REDOX POTENTIALS CIBA-GEIGY AG (CH) 1981-12-08 US claimed
EP-0014688-A2 Process for the treatment of silver dye-bleaching materials, aqueous preparation therefor, concentrate and process for making the preparation CIBA-GEIGY AG (CH) 1980-08-20 EP claimed
EP-0014688-B1 PROCESS FOR THE TREATMENT OF SILVER DYE-BLEACHING MATERIALS, AQUEOUS PREPARATION THEREFOR, CONCENTRATE AND PROCESS FOR MAKING THE PREPARATION CIBA-GEIGY AG (CH) 1983-03-23 EP disclosed
US-4304846-A USING MIXTURES OF A 1,4- OR 1,2-DIAZINE AS BLEACHING CATALYSTS; PREFERENTIAL REDOX POTENTIALS CIBA-GEIGY AG (CH) 1981-12-08 US disclosed
EP-0014688-A2 Process for the treatment of silver dye-bleaching materials, aqueous preparation therefor, concentrate and process for making the preparation CIBA-GEIGY AG (CH) 1980-08-20 EP disclosed