SCHEMBL8087668

SCHEMBL8087668

CCOc1ccc(OCC)c(C(=O)Nc2cc(OCC)c([N+]#N)cc2OCC)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.52
MAPT P10636 3/20 0.52
HPGD P15428 2/20 0.52
LMNA P02545 2/20 0.52
KDM4E B2RXH2 2/20 0.52
ATM Q13315 1/20 0.52
NPSR1 Q6W5P4 1/20 0.52
HSD17B10 Q99714 1/20 0.52
GAA P10253 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
TP53 P04637 1/20 0.48
PLAU P00749 1/20 0.47
ALDH1A1 P00352 2/20 0.47
EPHX1 P07099 2/20 0.46
MAPK1 P28482 1/20 0.46
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
RXFP1 Q9HBX9 1/20 0.45
HTT P42858 1/20 0.45

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
Hydrochloric Acid SCHEMBL11649575 0.86 MAPT (0.53) TSHRMAPTHPGDLMNAKDM4E
SCHEMBL4600880 0.81 MAPT (0.65) TSHRMAPTHPGDLMNAKDM4E
SCHEMBL31256869 0.81 MAPT (0.65) MAPTLMNAKDM4EGAAL3MBTL1
SCHEMBL3315675 0.81 MAPT (0.65) MAPTLMNAKDM4EGAAL3MBTL1
SCHEMBL7029827 0.80 MAPT (0.61) TSHRMAPTHPGDLMNAKDM4E
Hydrochloric Acid SCHEMBL1785872 0.80 MAPT (0.67) MAPTLMNAKDM4ENPSR1GAA
SCHEMBL11084460 0.79 ALDH1A1 (0.61) MAPTHPGDLMNAKDM4EGAA
SCHEMBL8004820 0.79 MAPT (0.60) TSHRMAPTLMNAKDM4EGAA
Hydrochloric Acid SCHEMBL8412071 0.79 MAPT (0.66) TSHRMAPTHPGDLMNAKDM4E
Hydrochloric Acid SCHEMBL11434618 0.79 MAPT (0.66) TSHRMAPTHPGDLMNAKDM4E

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-0679635-B1 Aromatic diazonium salts and their use in radiation-sensitive compositions AGFA GEVAERT NV (BE) 2000-09-27 EP disclosed
US-5776652-A Aromatic hexafluoropropanesulfonate diazonium salts and their use in radiation-sensitive mixtures AGFA-GEVAERT AG (DE) 1998-07-07 US disclosed
EP-0679635-A1 Aromatic diazonium salts and their use in radiation-sensitive compositions HOECHST AKTIENGESELLSCHAFT (DE) 1995-11-02 EP disclosed