SCHEMBL7053725

SCHEMBL7053725

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

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.52
RAB9A P51151 4/20 0.52
MEN1 O00255 3/20 0.52
KMT2A Q03164 3/20 0.52
LMNA P02545 3/20 0.52
MAPT P10636 3/20 0.52
HTT P42858 3/20 0.52
ALDH1A1 P00352 3/20 0.49
KDM4E B2RXH2 3/20 0.48
HSD17B10 Q99714 2/20 0.48
GAA P10253 1/20 0.48
ALOX15 P16050 1/20 0.48
GRM4 Q14833 1/20 0.47
HDAC6 Q9UBN7 1/20 0.47
CNR2 P34972 1/20 0.46
TSHR P16473 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
HPGD P15428 1/20 0.45
EGFR P00533 1/20 0.45
MMP1 P03956 1/20 0.45

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
SCHEMBL7053065 0.84 HPGD (0.50) NPC1RAB9AMEN1KMT2AHTT
SCHEMBL7056575 0.77 PLK4 (0.48) NPC1RAB9AMEN1KMT2ALMNA
SCHEMBL5047364 0.77 NPSR1 (0.65) NPC1RAB9AMEN1KMT2ALMNA
SCHEMBL30945434 0.76 MEN1 (0.59) NPC1RAB9AMEN1KMT2ALMNA
SCHEMBL29214067 0.76 MEN1 (0.59) NPC1RAB9AMEN1KMT2ALMNA
SCHEMBL10386066 0.72 MEN1 (0.54) NPC1RAB9AMEN1KMT2ALMNA
SCHEMBL11748968 0.72 MEN1 (0.67) NPC1RAB9AMEN1KMT2ALMNA
SCHEMBL22169641 0.72 MEN1 (0.57) NPC1RAB9AMEN1KMT2ALMNA
SCHEMBL7055928 0.71 PDK1 (0.55) NPC1RAB9AMEN1KMT2ALMNA
SCHEMBL11372757 0.71 MEN1 (0.56) NPC1RAB9AMEN1KMT2ALMNA

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