SCHEMBL7052537

SCHEMBL7052537

N#CC(C(=O)Nc1cccc(F)c1)c1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.61
MTOR P42345 1/20 0.54
GFER P55789 1/20 0.53
MEN1 O00255 5/20 0.53
KMT2A Q03164 5/20 0.53
ATM Q13315 1/20 0.53
RAB9A P51151 2/20 0.52
NPC1 O15118 1/20 0.52
HPGD P15428 1/20 0.52
MAPT P10636 3/20 0.49
POLB P06746 2/20 0.49
MAPK1 P28482 1/20 0.49
TSHR P16473 2/20 0.47
MAPK10 P53779 1/20 0.47
KCNH2 Q12809 1/20 0.47
MMP1 P03956 1/20 0.47
MMP2 P08253 1/20 0.47
MMP9 P14780 1/20 0.47
KCNK3 O14649 1/20 0.47
HTT P42858 1/20 0.46

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
SCHEMBL28762296 0.85 POLB (0.65) KDM4EMEN1KMT2AATMRAB9A
SCHEMBL7052543 0.84 KLK7 (0.56) MEN1KMT2ARAB9ANPC1HPGD
SCHEMBL7051985 0.83 HSD17B10 (0.50) MEN1KMT2AMAPTPOLBMAPK1
SCHEMBL7058595 0.83 NPC1 (0.55) KDM4EMEN1KMT2ARAB9ANPC1
SCHEMBL29522032 0.80 KDM4E (0.68) KDM4EMTORGFERMEN1KMT2A
SCHEMBL7210943 0.79 NPC1 (0.54) KDM4EGFERMEN1KMT2ARAB9A
SCHEMBL7053734 0.77 ALDH1A1 (0.58) KDM4EMEN1KMT2ARAB9AMAPT
SCHEMBL21880213 0.76 KDM4E (0.63) KDM4EMTORGFERMEN1KMT2A
SCHEMBL7054064 0.75 ALDH1A1 (0.58) MEN1KMT2ARAB9ANPC1MAPT
SCHEMBL7053950 0.75 ALDH1A1 (0.58) MEN1KMT2ARAB9ANPC1MAPT

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-6613931-B1 N-(3-chlorphenyl)-2-cyano-2-phenylacetamide BASF AKTIENGESELLSCHAFT (DE) 2003-09-02 US claimed
EP-1156715-B1 USE OF PHENYLACETAMIDES AS PLANT PROTECTIVES HAVING HERBICIDAL AND FUNGICIDAL EFFECT BASF AG (DE) 2003-05-07 EP claimed