SCHEMBL11526449

SCHEMBL11526449

CC(NC(c1ccccc1)c1ccccc1)P(O)O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MTOR P42345 1/20 0.40
RAB9A P51151 1/20 0.40
GRM7 Q14831 1/20 0.40
TSHR P16473 3/20 0.39
CYP3A4 P08684 2/20 0.39
ALOX15 P16050 2/20 0.39
HSD17B10 Q99714 2/20 0.39
ADRA2C P18825 2/20 0.39
CHRM2 P08172 1/20 0.39
ADRA1A P35348 1/20 0.39
RGS12 O14924 1/20 0.39
GLA P06280 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39
PKM P14618 1/20 0.39
ALOX12 P18054 1/20 0.39
NFKB1 P19838 1/20 0.39
HTR2A P28223 1/20 0.39
CYP2C19 P33261 1/20 0.39
THPO P40225 1/20 0.39

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
SCHEMBL2356180 0.80 MTOR (0.38) MTORRAB9AGRM7TSHRCYP3A4
SCHEMBL11523341 0.77 MTOR (0.41) MTORRAB9AGRM7TSHRCYP3A4
SCHEMBL11523104 0.76 ALDH1A1 (0.43) MTORRAB9AGRM7TSHRCYP3A4
SCHEMBL7991731 0.76 ADRA2C (0.48) MTORRAB9AGRM7TSHRCYP3A4
SCHEMBL9843925 0.75 MTOR (0.48) MTORRAB9AGRM7TSHRCYP3A4
SCHEMBL11524543 0.74 MEN1 (0.42) MTORRAB9AGRM7TSHRCYP3A4
SCHEMBL3281034 0.74 MTOR (0.57) MTORRAB9AGRM7TSHRCYP3A4
SCHEMBL21836227 0.73 SIGMAR1 (0.55) MTORRAB9AGRM7TSHRCYP3A4
SCHEMBL21836226 0.73 SIGMAR1 (0.55) MTORRAB9AGRM7TSHRCYP3A4
SCHEMBL11522566 0.72 AOC3 (0.44) MTORRAB9AGRM7TSHRCYP3A4

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-4147780-A α-Amino-phosphonous acids for inhibiting bacteria and yeast CIBA-GEIGY CORPORATION (US) 1979-04-03 US disclosed