SCHEMBL15538708

SCHEMBL15538708

CCOC(=O)Nc1ccc(N(C)c2ccc(F)cc2)cc1[N+](=O)[O-]

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.52
ALDH1A1 P00352 4/20 0.52
NPSR1 Q6W5P4 1/20 0.50
KCNQ4 P56696 4/20 0.48
KMT2A Q03164 2/20 0.48
KCNQ2 O43526 4/20 0.46
MTNR1A P48039 1/20 0.46
MTNR1B P49286 1/20 0.46
KCNQ5 Q9NR82 3/20 0.44
KCNQ3 O43525 3/20 0.44
CYP1A2 P05177 2/20 0.44
CYP2C9 P11712 2/20 0.44
CYP2C19 P33261 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.43
TDP1 Q9NUW8 2/20 0.43
MAPK1 P28482 2/20 0.43
LMNA P02545 2/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
MEN1 O00255 1/20 0.43
HTT P42858 1/20 0.43

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
SCHEMBL15172817 0.84 MAPT (0.55) MAPTALDH1A1NPSR1KCNQ4KMT2A
SCHEMBL15348100 0.81 KCNQ2 (0.66) MAPTALDH1A1KCNQ4KMT2AKCNQ2
SCHEMBL6004947 0.79 CYP1A2 (0.65) MAPTALDH1A1KMT2ACYP1A2CYP2C9
SCHEMBL20129857 0.78 MAPT (0.49) MAPTALDH1A1NPSR1KCNQ4KMT2A
SCHEMBL2235641 0.78 KCNQ2 (0.70) MAPTALDH1A1KCNQ4KMT2AKCNQ2
SCHEMBL6005439 0.78 KCNQ2 (0.64) MAPTALDH1A1KCNQ4KMT2AKCNQ2
SCHEMBL14638232 0.78 PKM (0.50) MAPTALDH1A1NPSR1KCNQ4KMT2A
SCHEMBL11159531 0.77 MAPT (0.62) MAPTALDH1A1KMT2ACYP1A2CYP2C9
SCHEMBL14636542 0.77 CYP1A2 (0.49) MAPTALDH1A1NPSR1KCNQ4KMT2A
SCHEMBL8966391 0.77 CYP1A2 (0.49) MAPTALDH1A1NPSR1KCNQ4KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2013179298-A2 A PROCESS FOR PREPARATION OF PHENYL CARBAMATE DERIVATIVE AND POLYMORPHIC FORMS THEREOF CADILA HEALTHCARE LIMITED (IN) 2013-12-05 WO disclosed