SCHEMBL2319613

SCHEMBL2319613

C=C(C)C(=O)NCCC(C[N+](C)(C)C)OP(=O)(O)O

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
CYP1A2 P05177 1/20 0.35
HRH1 P35367 1/20 0.35
LMNA P02545 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
CYP2C19 P33261 1/20 0.31
RECQL P46063 1/20 0.31

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
SCHEMBL2319797 0.81 ZDHHC20 (0.36)
Methacrylic Acid SCHEMBL28639504 0.77 LMNA (0.36) MEN1KMT2ACYP1A2HRH1LMNA
SCHEMBL3882717 0.76 FAAH (0.33)
SCHEMBL176508 0.76 THRB (0.38) MEN1KMT2ACYP1A2HRH1LMNA
SCHEMBL632263 0.76 TGFBR1 (0.33)
SCHEMBL2944691 0.75 THRB (0.44) MEN1KMT2ACYP1A2HRH1LMNA
SCHEMBL541861 0.74 TSHR (0.42) MEN1KMT2ACYP1A2HRH1LMNA
SCHEMBL541372 0.73 TSHR (0.44) MEN1KMT2ACYP1A2HRH1LMNA
Methacrylic Acid SCHEMBL3884365 0.73 SMN1; SMN2 (0.36) MEN1KMT2ACYP1A2HRH1LMNA
SCHEMBL20657965 0.72 S1PR1 (0.35)

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-7993052-B2 Agitation mixer and feed pipe structure NOF CORPORATION (JP) 2011-08-09 US disclosed
US-20080080304-A1 AGITATION METHOD, AGITATION MIXER, AND FEED PIPE STRUCTURE NOF CORPORATION (JP) 2008-04-03 US disclosed