SCHEMBL5167320

SCHEMBL5167320

CN(CC(=O)c1ccc(Cl)cc1Cl)Cc1ccc(C(C)(C)C)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FLT1 P17948 1/20 0.48
FLT4 P35916 1/20 0.48
KDR P35968 1/20 0.48
ALDH1A1 P00352 3/20 0.47
MAPK1 P28482 1/20 0.47
HIF1A Q16665 1/20 0.47
TMEM97 Q5BJF2 2/20 0.46
SIGMAR1 Q99720 2/20 0.46
NR1H4 Q96RI1 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
LMNA P02545 1/20 0.44
HTT P42858 1/20 0.44
KCNH2 Q12809 1/20 0.44
ESRRB O95718 1/20 0.44
ESRRG P62508 1/20 0.44
ERCC5 P28715 1/20 0.43
FEN1 P39748 1/20 0.43
CYP19A1 P11511 1/20 0.42
MEN1 O00255 1/20 0.42
CYP1A2 P05177 1/20 0.42

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
SCHEMBL6247138 0.86 SIGMAR1 (0.45) ALDH1A1TMEM97SIGMAR1NR1H4SMN1; SMN2
SCHEMBL5165653 0.85 FLT1 (0.43) FLT1FLT4KDRALDH1A1MAPK1
SCHEMBL5182136 0.83 MEN1 (0.55) ALDH1A1TMEM97SIGMAR1NR1H4SMN1; SMN2
SCHEMBL5167511 0.80 PPARG (0.49) TMEM97SIGMAR1NR1H4SMN1; SMN2LMNA
SCHEMBL5182316 0.80 MAPT (0.44) TMEM97SIGMAR1NR1H4SMN1; SMN2LMNA
SCHEMBL5166698 0.78 SIGMAR1 (0.51) ALDH1A1MAPK1TMEM97SIGMAR1NR1H4
SCHEMBL5166146 0.76 KMT2A (0.47) MAPK1TMEM97SIGMAR1NR1H4SMN1; SMN2
SCHEMBL6247255 0.76 ESRRG (0.55) HIF1ATMEM97SIGMAR1NR1H4LMNA
SCHEMBL9490560 0.76 ALDH1A1 (0.62) ALDH1A1MAPK1HIF1ATMEM97SIGMAR1
SCHEMBL5170410 0.75 HPGD (0.48) TMEM97SIGMAR1NR1H4LMNAKCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6329399-B1 Antifungal amine derivatives and processing for producing the same POLA CHEMICAL INDUSTRIES, INC. (JP) 2001-12-11 US claimed
EP-1020426-A1 AMINE DERIVATIVES AND PROCESS FOR PRODUCING THE SAME POLA CHEMICAL INDUSTRIES, INC. (JP) 2000-07-19 EP claimed
EP-1561744-B1 AMINE DERIVATIVES, PROCESS FOR PRODUCING THE SAME AND THEIR USE AS ANTIMYCOTIC AGENT POLA CHEM IND INC (JP) 2007-04-18 EP disclosed
EP-1561744-A2 AMINE DERIVATIVES, PROCESS FOR PRODUCING THE SAME AND THEIR USE AS ANTIMYCOTIC AGENT POLA CHEMICAL INDUSTRIES INC. (JP) 2005-08-10 EP disclosed
US-6329399-B1 Antifungal amine derivatives and processing for producing the same POLA CHEMICAL INDUSTRIES, INC. (JP) 2001-12-11 US disclosed
EP-1020426-A1 AMINE DERIVATIVES AND PROCESS FOR PRODUCING THE SAME POLA CHEMICAL INDUSTRIES, INC. (JP) 2000-07-19 EP disclosed