SCHEMBL7871508

SCHEMBL7871508

CCOC(=O)C(C)=Cc1ccccc1[N+](=O)[O-]

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.59
NPSR1 Q6W5P4 1/20 0.59
ALDH1A1 P00352 4/20 0.55
GLO1 Q04760 1/20 0.49
STAT3 P40763 1/20 0.49
LMNA P02545 4/20 0.48
KMT2A Q03164 3/20 0.48
MEN1 O00255 2/20 0.48
PLIN1 O60240 1/20 0.48
POLB P06746 1/20 0.48
PLIN5 Q00G26 1/20 0.48
ABHD5 Q8WTS1 1/20 0.48
RAB9A P51151 3/20 0.47
NPC1 O15118 2/20 0.46
CES2 O00748 1/20 0.46
ACHE P22303 1/20 0.46
CES1 P23141 1/20 0.46
ADORA3 P0DMS8 1/20 0.45
ATM Q13315 1/20 0.45
SMN1; SMN2 Q16637 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
SCHEMBL11107929 1.00 MAPT (0.59) MAPTNPSR1ALDH1A1GLO1STAT3
SCHEMBL1373654 0.89 MAPT (0.71) MAPTNPSR1ALDH1A1GLO1STAT3
SCHEMBL29043783 0.86 MAPT (0.64) MAPTNPSR1ALDH1A1GLO1STAT3
SCHEMBL10386660 0.86 MAPT (0.64) MAPTNPSR1ALDH1A1GLO1STAT3
SCHEMBL30553800 0.86 MAPT (0.64) MAPTNPSR1ALDH1A1GLO1STAT3
SCHEMBL7270940 0.86 MAPT (0.64) MAPTNPSR1ALDH1A1GLO1STAT3
SCHEMBL12469566 0.86 MAPT (0.59) MAPTNPSR1ALDH1A1GLO1STAT3
SCHEMBL12469569 0.86 MAPT (0.59) MAPTNPSR1ALDH1A1GLO1STAT3
SCHEMBL12469568 0.86 MAPT (0.59) MAPTNPSR1ALDH1A1GLO1STAT3
SCHEMBL16046409 0.86 MAPT (0.59) MAPTNPSR1ALDH1A1GLO1STAT3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6329546-B1 FOR INVESTIGATING THE MECHANISM OF ACTION OF A PHYSIOLOGICALLY ACTIVE AMINO ACID COMPOUND SUCH AS GLUTAMIC ACID IN AN ORGANISM LABORATORY OF MOLECULAR BIOPHOTONICS (JP) 2001-12-11 US disclosed
US-6229020-B1 REACTING N-SUCCINIMIDYL AND P-NITROPHENYL CINNAMATE DERIVATIVES WITH PHYSIOLOGICALLY ACTIVE SUBSTANCE SUCH AS AN AMINO ACID; PROTECTING AMINO OR HYDROXY GROUPS FOR ANALYSIS OF BIOLOGICAL REACTIONS BY IRRADIATION WITH LIGHT LABORATORY OF MOLECULAR BIOPHOTONICS (JP) 2001-05-08 US disclosed
EP-0047119-B1 CARBOXAMIDE COMPOUNDS AS SRS-A ANTAGONISTS, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM, PROCESSES FOR THE PREPARATION, AND INTERMEDIATES USEFUL THEREIN PFIZER INC. (US) 1984-05-09 EP disclosed
US-4343813-A ANTIANAPHYLACTIC AGENTS PFIZER INC. (US) 1982-08-10 US disclosed
US-4331683-A SENSITIZATION, ANTIALLERGENS PFIZER INC. (US) 1982-05-25 US disclosed
US-4296129-A ANTIAASTHMATIC INHIBITOR OF SLOW-REACTING SUBSTANCE OF ANAPHYLAXIS PFIZER, INC. (US) 1981-10-20 US disclosed
US-4296120-A ANTIANAPHYLACTIC PFIZER INC. (US) 1981-10-20 US disclosed