SCHEMBL882804

SCHEMBL882804

CCCC(=O)Nc1cccc(NC(=O)c2ccc(F)cc2)c1

nearest known ligand 0.72

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.72
MEN1 O00255 4/20 0.72
F2R P25116 10/20 0.67
KCNK3 O14649 1/20 0.67
KCNK9 Q9NPC2 1/20 0.67
ALDH1A1 P00352 2/20 0.64
SMN1; SMN2 Q16637 3/20 0.62
TP53 P04637 1/20 0.62
HTT P42858 1/20 0.62
L3MBTL1 Q9Y468 1/20 0.60

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
SCHEMBL882798 0.87 F2R (0.68) KMT2AMEN1F2RALDH1A1SMN1; SMN2
SCHEMBL10069466 0.87 F2R (0.82) KMT2AMEN1F2RKCNK3KCNK9
SCHEMBL882777 0.86 F2R (0.66) KMT2AMEN1F2RKCNK3ALDH1A1
SCHEMBL10069967 0.86 KMT2A (0.85) KMT2AMEN1F2RALDH1A1SMN1; SMN2
SCHEMBL882800 0.86 F2R (0.67) KMT2AMEN1F2RKCNK3ALDH1A1
SCHEMBL2358354 0.85 MEN1 (1.00) KMT2AMEN1KCNK3KCNK9SMN1; SMN2
SCHEMBL882790 0.84 KCNK9 (0.71) KMT2AMEN1F2RKCNK3KCNK9
SCHEMBL10975643 0.83 F2R (0.73) F2RALDH1A1TP53
SCHEMBL882805 0.83 ADORA3 (0.64) KMT2AMEN1F2RALDH1A1SMN1; SMN2
SCHEMBL8088822 0.82 MEN1 (0.72) KMT2AMEN1F2RALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9422262-B2 Compounds and methods for treating diseases mediated by protease activated receptors THE BROAD INSTITUTE, INC. (US) 2016-08-23 US disclosed
US-9422262-B2 Compounds and methods for treating diseases mediated by protease activated receptors THE BROAD INSTITUTE, INC. (US) 2016-08-23 US disclosed
WO-2012040636-A2 COMPOUNDS AND METHODS FOR TREATING DISEASES MEDIATED BY PROTEASE ACTIVATED RECEPTORS THE BROAD INSTITUTE, INC. (US) 2012-03-29 WO disclosed