SCHEMBL6836162

SCHEMBL6836162

CCNc1nc(NCC)nc(N(O)O)n1

nearest known ligand 0.61

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.61
L3MBTL1 Q9Y468 3/20 0.61
CYP1A2 P05177 3/20 0.61
CYP2C19 P33261 3/20 0.61
KDM4E B2RXH2 1/20 0.55
LMNA P02545 1/20 0.52
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
MCL1 Q07820 1/20 0.47
HTT P42858 3/20 0.44
ALDH1A1 P00352 4/20 0.44
CREBBP Q92793 2/20 0.44
POLB P06746 1/20 0.42
TSHR P16473 1/20 0.41

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
SCHEMBL14380958 0.84 L3MBTL1 (0.64) GAAL3MBTL1CYP1A2CYP2C19KDM4E
SCHEMBL1034033 0.80 LMNA (0.74) GAAL3MBTL1CYP1A2CYP2C19KDM4E
SCHEMBL761988 0.77 GAA (0.61) GAAL3MBTL1CYP1A2CYP2C19KDM4E
SCHEMBL6716129 0.77 GAA (0.61) GAAL3MBTL1CYP1A2CYP2C19KDM4E
Hydrochloric Acid SCHEMBL11741238 0.77 LMNA (0.70) GAAL3MBTL1CYP1A2CYP2C19KDM4E
SCHEMBL17367630 0.77 GAA (0.55) GAAL3MBTL1CYP1A2CYP2C19KDM4E
SCHEMBL6131320 0.77 GAA (0.50) GAAL3MBTL1CYP1A2CYP2C19KDM4E
SCHEMBL13295561 0.75 GAA (0.53) GAAL3MBTL1CYP1A2CYP2C19KDM4E
SCHEMBL14557570 0.74 GAA (0.52) GAAL3MBTL1CYP1A2CYP2C19KDM4E
SCHEMBL5011028 0.73 LMNA (0.58) GAAL3MBTL1CYP1A2CYP2C19KDM4E

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
US-20040009441-A1 Thermally developable photosensitive material FUJI PHOTO FILM CO., LTD. (JP) 2004-01-15 US disclosed
EP-1355190-A1 Thermally developable photosensitive material FUJI PHOTO FILM CO., LTD. (JP) 2003-10-22 EP disclosed
US-20020076663-A1 HEAT-DEVELOPABLE RECORDING MATERIAL FUJIFILM CORPORATION (JP) 2002-06-20 US disclosed