SCHEMBL9879487

SCHEMBL9879487

O=C(Nc1cccc(C(F)(F)F)c1)C(Cl)c1ccccc1F

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.55
MEN1 O00255 4/20 0.55
KMT2A Q03164 4/20 0.55
HTT P42858 2/20 0.55
RAB9A P51151 1/20 0.55
KDR P35968 1/20 0.53
ALDH1A1 P00352 2/20 0.53
CYP1A2 P05177 1/20 0.53
POLB P06746 1/20 0.53
CYP3A4 P08684 1/20 0.53
CYP2C9 P11712 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
GRIK1 P39086 1/20 0.49
P2RX1 P51575 1/20 0.49
TP53 P04637 1/20 0.49
IDO1 P14902 1/20 0.48
PTGS1 P23219 1/20 0.48
GAA P10253 1/20 0.48
XBP1 P17861 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48

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
SCHEMBL9871765 0.83 ALDH1A1 (0.67) MAPTMEN1KMT2AHTTRAB9A
SCHEMBL9338885 0.81 MAPT (0.62) MAPTMEN1KMT2AHTTRAB9A
SCHEMBL9872426 0.80 MEN1 (0.57) MAPTMEN1KMT2AHTTRAB9A
SCHEMBL9795433 0.80 MEN1 (0.56) MAPTMEN1KMT2AHTTRAB9A
SCHEMBL19638131 0.78 SMN1; SMN2 (0.60) MAPTMEN1KMT2AHTTRAB9A
SCHEMBL9795561 0.78 NTRK1 (0.57) MAPTMEN1KMT2AHTTRAB9A
SCHEMBL9795519 0.77 MAPT (0.58) MAPTMEN1KMT2AHTTRAB9A
SCHEMBL28878841 0.76 MAPT (0.64) MAPTMEN1KMT2AHTTRAB9A
SCHEMBL5561958 0.75 SMN1; SMN2 (0.63) MAPTMEN1KMT2AHTTRAB9A
SCHEMBL31093984 0.75 SMN1; SMN2 (0.63) MAPTMEN1KMT2AHTTRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5076832-A Certain 3-(substituted phenyl)-5-(substituted phenyl)-1-ethylimidazolidine-4-ones as herbicides ICI AMERICAS INC. (US) 1991-12-31 US disclosed