SCHEMBL5594545

SCHEMBL5594545

CC(OC(C)(c1ccccc1)[N+](=O)[O-])(c1ccccc1)[N+](=O)[O-]

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.41
ALDH1A1 P00352 5/20 0.39
ALOX15 P16050 1/20 0.39
LMNA P02545 1/20 0.38
MAPT P10636 1/20 0.36
KMT2A Q03164 1/20 0.36
KCNN4 O15554 1/20 0.35
CYP2C19 P33261 1/20 0.35
HIF1A Q16665 1/20 0.35
TAAR1 Q96RJ0 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
HDAC3 O15379 1/20 0.34
HDAC4 P56524 1/20 0.34
HDAC1 Q13547 1/20 0.34
HDAC7 Q8WUI4 1/20 0.34
HDAC2 Q92769 1/20 0.34
HDAC10 Q969S8 1/20 0.34
HDAC11 Q96DB2 1/20 0.34
HDAC8 Q9BY41 1/20 0.34
HDAC6 Q9UBN7 1/20 0.34

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
SCHEMBL5983521 0.81 MAPK1 (0.36) MAPK1ALDH1A1ALOX15LMNAMAPT
SCHEMBL5682426 0.78 CYP2C19 (0.41) MAPK1ALDH1A1ALOX15LMNAMAPT
SCHEMBL27626724 0.78 KMT2A (0.46) MAPK1ALDH1A1ALOX15MAPTKMT2A
SCHEMBL187341 0.76 CYP2C19 (0.43) MAPK1ALDH1A1ALOX15LMNAMAPT
SCHEMBL9202591 0.76 ALDH1A1 (0.42) MAPK1ALDH1A1ALOX15LMNAMAPT
SCHEMBL1170985 0.76 ALDH1A1 (0.42) MAPK1ALDH1A1ALOX15LMNAMAPT
SCHEMBL10531816 0.75 ELANE (0.38) MAPK1ALDH1A1ALOX15MAPTKMT2A
SCHEMBL2821428 0.74 ALDH1A1 (0.41) MAPK1ALDH1A1ALOX15LMNAKMT2A
SCHEMBL7025394 0.74 ALDH1A1 (0.41) MAPK1ALDH1A1ALOX15LMNAMAPT
SCHEMBL8932003 0.74 MAPT (0.43) MAPK1ALDH1A1ALOX15LMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007113575-A2 REAGENTS AND METHODS FOR CROSS-LINKING BIOLOGICAL MOLECULES THE UNIVERSITY OF BATH (GB) 2007-10-11 WO claimed
CN-108496233-B Capacitor with a capacitor element 日本贵弥功株式会社 2020-09-04 CN disclosed
CN-110770862-A Electrode foil for capacitor and capacitor 日本贵弥功株式会社 2020-02-07 CN disclosed
WO-2007113575-A2 REAGENTS AND METHODS FOR CROSS-LINKING BIOLOGICAL MOLECULES THE UNIVERSITY OF BATH (GB) 2007-10-11 WO disclosed