SCHEMBL11486200

SCHEMBL11486200

N#Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.51
NPC1 O15118 4/20 0.48
RAB9A P51151 4/20 0.48
ALDH1A1 P00352 3/20 0.48
LMNA P02545 1/20 0.48
PKM P14618 1/20 0.48
HPGD P15428 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
NQO2 P16083 1/20 0.46
KMT2A Q03164 6/20 0.45
MEN1 O00255 5/20 0.45
TDP1 Q9NUW8 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
BRAF P15056 1/20 0.43
HTT P42858 1/20 0.43
PGR P06401 1/20 0.43
TNKS O95271 1/20 0.42
PARP1 P09874 1/20 0.42
CSNK2A2 P19784 1/20 0.42
CSNK2B P67870 1/20 0.42

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
SCHEMBL2323095 0.85 MAPT (0.53) MAPTNPC1RAB9AALDH1A1LMNA
SCHEMBL3361349 0.82 MAPT (0.64) MAPTNPC1RAB9AALDH1A1LMNA
SCHEMBL395933 0.82 PGR (0.46) MAPTALDH1A1LMNAHPGDNQO2
SCHEMBL27632460 0.75 MAPT (0.57) MAPTNPC1RAB9AALDH1A1LMNA
SCHEMBL29273189 0.75 KMT2A (0.60) MAPTNPC1RAB9AALDH1A1LMNA
SCHEMBL11606898 0.74 MMP3 (0.43) ALDH1A1PGRTNKS
SCHEMBL19926009 0.74 MAPT (0.55) MAPTNPC1RAB9AALDH1A1LMNA
SCHEMBL2615714 0.74 MAPT (0.55) MAPTNPC1RAB9AALDH1A1LMNA
SCHEMBL6734270 0.74 MAPT (0.55) MAPTNPC1RAB9AALDH1A1LMNA
SCHEMBL4072821 0.73 MAPT (0.68) MAPTALDH1A1LMNAPKMHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4217286-A 5-Phenyl-2-furancarboximidamides MORTON-NORWICH PRODUCTS, INC. (US) 1980-08-12 US disclosed
US-3946049-A 5-PHENYL-2-FURAMIDOXIMES MORTON-NORWICH PRODUCTS, INC. (US) 1976-03-23 US disclosed