SCHEMBL7053734

SCHEMBL7053734

N#CC(C(=O)Nc1cc(Cl)cc(Cl)c1)c1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.58
GAA P10253 1/20 0.58
SMN1; SMN2 Q16637 1/20 0.57
KDM4E B2RXH2 1/20 0.54
LMNA P02545 3/20 0.53
KMT2A Q03164 6/20 0.52
MEN1 O00255 5/20 0.51
MAPT P10636 4/20 0.51
RAB9A P51151 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51
STARD7 Q9NQZ5 1/20 0.48
PCTP Q9UKL6 1/20 0.48
STARD10 Q9Y365 1/20 0.48
DHODH Q02127 1/20 0.47
POLB P06746 1/20 0.46
ELANE P08246 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
EGFR P00533 1/20 0.44

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
SCHEMBL7058595 0.89 NPC1 (0.55) ALDH1A1GAAKDM4ELMNAKMT2A
SCHEMBL28762296 0.84 POLB (0.65) ALDH1A1GAASMN1; SMN2KDM4ELMNA
SCHEMBL7210943 0.84 NPC1 (0.54) ALDH1A1GAASMN1; SMN2KDM4ELMNA
SCHEMBL7115753 0.82 MEN1 (0.49) ALDH1A1GAALMNAKMT2AMEN1
SCHEMBL7052543 0.78 KLK7 (0.56) ALDH1A1GAASMN1; SMN2LMNAKMT2A
SCHEMBL7053950 0.78 ALDH1A1 (0.58) ALDH1A1SMN1; SMN2LMNAKMT2AMEN1
SCHEMBL7052548 0.78 MEN1 (0.44) ALDH1A1LMNAKMT2AMEN1MAPT
SCHEMBL7051985 0.77 HSD17B10 (0.50) ALDH1A1LMNAKMT2AMEN1MAPT
SCHEMBL7052537 0.77 KDM4E (0.61) KDM4EKMT2AMEN1MAPTRAB9A
SCHEMBL9394207 0.77 FNTA (0.49) ALDH1A1SMN1; SMN2LMNAMAPTNPSR1

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