SCHEMBL14280277

SCHEMBL14280277

CCC(C)(C)CC(C)c1ccccc1NC(=O)c1ccccc1C(F)(F)F

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.46
KCNK3 O14649 3/20 0.46
KCNK9 Q9NPC2 3/20 0.46
RXFP1 Q9HBX9 2/20 0.46
F2R P25116 1/20 0.45
LMNA P02545 1/20 0.44
GAA P10253 1/20 0.44
POLB P06746 2/20 0.42
MAPK1 P28482 1/20 0.42
CCR8 P51685 1/20 0.42
PTPRC P08575 1/20 0.41
PTGES O14684 2/20 0.41
HDAC3 O15379 1/20 0.41
HDAC1 Q13547 1/20 0.41
PTGS1 P23219 1/20 0.41
RECQL P46063 1/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
TP53 P04637 1/20 0.40
MAPT P10636 1/20 0.40

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
SCHEMBL272581 0.90 SMN1; SMN2 (0.49) SMN1; SMN2KCNK3KCNK9RXFP1F2R
SCHEMBL5526714 0.87 SMN1; SMN2 (0.51) SMN1; SMN2KCNK3KCNK9RXFP1F2R
SCHEMBL27849076 0.85 TDP1 (0.43) RXFP1LMNAGAAMAPK1MEN1
SCHEMBL272926 0.83 SMN1; SMN2 (0.50) SMN1; SMN2KCNK3KCNK9RXFP1F2R
SCHEMBL14364828 0.83 SMN1; SMN2 (0.50) SMN1; SMN2KCNK3KCNK9RXFP1F2R
SCHEMBL14364829 0.83 SMN1; SMN2 (0.50) SMN1; SMN2KCNK3KCNK9RXFP1F2R
SCHEMBL21311187 0.81 SMN1; SMN2 (0.56) SMN1; SMN2KCNK3KCNK9RXFP1F2R
SCHEMBL13645646 0.81 SMN1; SMN2 (0.48) SMN1; SMN2KCNK3KCNK9RXFP1F2R
SCHEMBL13295630 0.81 LMNA (0.49) LMNAGAAPOLB
SCHEMBL13295586 0.79 MAPK1 (0.59) SMN1; SMN2LMNAGAAPOLBMAPK1

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-7314958-B2 Phenylbenzamides BAYER CROPSCIENCE AG (DE) 2008-01-01 US disclosed
US-7314958-B2 Phenylbenzamides BAYER CROPSCIENCE AG (DE) 2008-01-01 US disclosed