SCHEMBL7874904

SCHEMBL7874904

CCOC(=O)c1[nH]nc(C(=O)c2ccccc2)c1C(=O)c1ccc(Cl)cc1[N+](=O)[O-]

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.45
LMNA P02545 6/20 0.45
MAPK1 P28482 2/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
HPGD P15428 6/20 0.43
CYP1A2 P05177 2/20 0.43
CYP2C19 P33261 2/20 0.43
CYP3A4 P08684 1/20 0.43
ALOX15 P16050 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
HTT P42858 2/20 0.41
NR2F2 P24468 1/20 0.41
KCNMA1 Q12791 1/20 0.40
RAB9A P51151 2/20 0.40
NPC1 O15118 1/20 0.40
NPSR1 Q6W5P4 2/20 0.40
TDP1 Q9NUW8 1/20 0.40
ALDH1A1 P00352 1/20 0.39

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
SCHEMBL7868349 0.91 MAPT (0.46) MAPTLMNAMAPK1MEN1KMT2A
SCHEMBL8459364 0.86 HPGD (0.44) MAPTLMNAMAPK1MEN1KMT2A
SCHEMBL7863072 0.86 HPGDS (0.44) MAPTLMNAMAPK1MEN1KMT2A
SCHEMBL7863165 0.85 ALOX15 (0.49) MAPTLMNAHPGDCYP1A2CYP2C19
SCHEMBL7863171 0.81 HPGD (0.43) MAPTLMNAMAPK1MEN1KMT2A
SCHEMBL7869910 0.78 KCNMA1 (0.46) MAPTLMNAMAPK1MEN1KMT2A
Alcohol SCHEMBL27634214 0.75 HPGD (0.56) MAPTLMNAMEN1KMT2AHPGD
SCHEMBL7868363 0.74 ALOX15 (0.54) MAPTLMNAMEN1KMT2AHPGD
SCHEMBL11289155 0.74 HPGD (0.59) MAPTLMNAMAPK1HPGDCYP1A2
SCHEMBL7863149 0.74 KCNMA1 (0.44) MAPTLMNAMAPK1MEN1KMT2A

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-6313290-B1 Azolobenzazepine derivatives and compositions and method of use thereof ZENECA LIMITED (GB) 2001-11-06 US disclosed
US-6124281-A TREATING STROKES ZENECA LIMITED (GB) 2000-09-26 US disclosed