SCHEMBL7033535

SCHEMBL7033535

O=[N+]([O-])c1ccc2nc(CCCCCCCCc3nc4ccc([N+](=O)[O-])cc4[nH]3)[nH]c2c1

nearest known ligand 0.91

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.91
ALDH1A1 P00352 4/20 0.91
KCNJ1 P48048 2/20 0.91
LMNA P02545 2/20 0.91
PKM P14618 4/20 0.82
KDM4E B2RXH2 2/20 0.77
RIPK1 Q13546 3/20 0.65
TDP1 Q9NUW8 3/20 0.60
MEN1 O00255 3/20 0.57
KMT2A Q03164 3/20 0.57
L3MBTL1 Q9Y468 3/20 0.57
NPC1 O15118 3/20 0.57
RAB9A P51151 3/20 0.57
HTT P42858 2/20 0.57
MMP2 P08253 1/20 0.57
MMP9 P14780 1/20 0.57
MMP8 P22894 1/20 0.57
CASP3 P42574 1/20 0.57
MMP13 P45452 1/20 0.57
SENP8 Q96LD8 1/20 0.57

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
SCHEMBL9642133 0.95 MAPT (1.00) MAPTALDH1A1KCNJ1LMNAPKM
SCHEMBL9721028 0.93 KDM4E (0.81) MAPTALDH1A1KCNJ1LMNAPKM
SCHEMBL9720952 0.93 KDM4E (0.81) MAPTALDH1A1KCNJ1LMNAPKM
SCHEMBL783687 0.93 KDM4E (0.81) MAPTALDH1A1KCNJ1LMNAPKM
SCHEMBL1250581 0.92 KDM4E (0.82) MAPTALDH1A1KCNJ1LMNAPKM
SCHEMBL7608611 0.90 KDM4E (0.85) MAPTALDH1A1KCNJ1LMNAPKM
SCHEMBL7033532 0.88 MAPT (0.72) MAPTALDH1A1KCNJ1LMNAPKM
SCHEMBL8601357 0.87 KDM4E (1.00) MAPTALDH1A1KCNJ1LMNAPKM
SCHEMBL18459774 0.85 MAPT (0.76) MAPTALDH1A1KCNJ1LMNAPKM
SCHEMBL521103 0.84 PKM (0.75) MAPTALDH1A1KCNJ1LMNAPKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-6048942-A None JP disclosed
EP-0583665-B1 Pharmaceutical composition and method for treating hyperlipidemia and arteriosclerosis FUJI PHOTO FILM CO LTD (JP) 2003-03-05 EP disclosed
US-5387600-A Anticholesterol agents; antilipemic agents FUJI PHOTO FILM CO., LTD. (JP) 1995-02-07 US disclosed
EP-0583665-A2 Pharmaceutical composition and method for treating hyperlipidemia and arteriosclerosis FUJI PHOTO FILM CO., LTD. (JP) 1994-02-23 EP disclosed
JP-H0648942-A ANTIHYPERLIPEMIA PREPARATION AND ANTIARTERIOSCLORETIC PREPARATION FUJI PHOTO FILM CO LTD 1994-02-22 JP disclosed