SCHEMBL10893204

SCHEMBL10893204

CCN(CC)CCNc1ccc(C(F)(F)F)cc1

nearest known ligand 0.58

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MCHR1 Q99705 4/20 0.58
▸ LMNA P02545 3/20 0.45
▸ MEN1 O00255 3/20 0.44
▸ KMT2A Q03164 3/20 0.44
▸ KIF11 P52732 2/20 0.43
▸ CHEK1 O14757 1/20 0.43
▸ PIM1 P11309 1/20 0.43
▸ IDO1 P14902 1/20 0.43
▸ LTK P29376 1/20 0.43
▸ LIMK1 P53667 1/20 0.43
▸ CLK4 Q9HAZ1 1/20 0.43
▸ HTT P42858 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ NPSR1 Q6W5P4 1/20 0.42
▸ POLB P06746 1/20 0.41
▸ KCNH2 Q12809 2/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ NFKB1 P19838 1/20 0.41
▸ CACNA1B Q00975 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
SCHEMBL10889868 0.90 MCHR1 (0.52) MCHR1LMNAMEN1KMT2AKIF11
SCHEMBL10891453 0.86 MCHR1 (0.45) MCHR1LMNAMEN1KMT2ACHEK1
SCHEMBL4577498 0.83 MCHR1 (0.43) MCHR1LMNAMEN1KMT2ACHEK1
SCHEMBL10891643 0.80 MCHR1 (0.52) MCHR1LMNAMEN1KMT2AHTT
SCHEMBL9364512 0.79 MAPT (0.61) MCHR1MEN1KMT2ACHEK1PIM1
SCHEMBL4268165 0.79 MEN1 (0.59) LMNAMEN1KMT2AKIF11HTT
SCHEMBL10889965 0.78 MCHR1 (0.60) MCHR1LMNAMEN1KMT2AKIF11
SCHEMBL4006637 0.78 ALDH1A1 (0.54) MCHR1LMNAMEN1KMT2ACHEK1
SCHEMBL10894905 0.78 SIGMAR1 (0.56) MCHR1MEN1KMT2ACHEK1PIM1
SCHEMBL1724150 0.78 MEN1 (0.59) LMNAMEN1KMT2ACHEK1PIM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4596891-A PHENYL-N,N'-DIETHYLETHYLENE DIAMINES DUPHAR INTERNATIONAL RESEARCH B.V. (NL) 1986-06-24 — — US claimed
US-4596891-A PHENYL-N,N'-DIETHYLETHYLENE DIAMINES DUPHAR INTERNATIONAL RESEARCH B.V. (NL) 1986-06-24 — — US disclosed
US-4286983-A INCLUDING COMPOUNDS OF THE N-PHENYL-N',N'-DIETHYL ALKYLENEDIAMINE TYPE DUPHAR INTERNATIONAL RESEARCH B.V. (NL) 1981-09-01 — — US disclosed
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