SCHEMBL1697437

SCHEMBL1697437

NC(=O)OOOC(=O)Nc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.51
▸ MAPT P10636 2/20 0.51
▸ MEN1 O00255 2/20 0.51
▸ KMT2A Q03164 2/20 0.51
▸ GAA P10253 3/20 0.47
▸ GFER P55789 1/20 0.47
▸ SMN1; SMN2 Q16637 6/20 0.47
▸ TSHR P16473 3/20 0.47
▸ TP53 P04637 2/20 0.47
▸ EPHX1 P07099 1/20 0.47
▸ EPHX2 P34913 1/20 0.47
▸ CDK9 P50750 1/20 0.47
▸ CLK4 Q9HAZ1 1/20 0.47
▸ RAB9A P51151 3/20 0.46
▸ F13A1 P00488 1/20 0.45
▸ TGM2 P21980 1/20 0.45
▸ HTT P42858 1/20 0.45
▸ HSD17B10 Q99714 2/20 0.44
▸ TYR P14679 1/20 0.44
▸ TAS2R38 P59533 1/20 0.44

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
SCHEMBL9074710 0.89 ALDH1A1 (0.54) ALDH1A1MAPTMEN1KMT2AGAA
SCHEMBL8827353 0.82 SMN1; SMN2 (0.61) ALDH1A1MAPTMEN1KMT2AGAA
SCHEMBL9065932 0.79 SMN1; SMN2 (0.52) ALDH1A1MAPTMEN1KMT2AGAA
Methyl Carbamate SCHEMBL28148376 0.77 SMN1; SMN2 (0.62) ALDH1A1MAPTMEN1KMT2AGAA
SCHEMBL28333317 0.75 SMN1; SMN2 (0.58) ALDH1A1MAPTMEN1KMT2AGAA
SCHEMBL4315341 0.74 SMN1; SMN2 (0.56) ALDH1A1MAPTMEN1KMT2AGAA
SCHEMBL1697460 0.74 PLAU (0.49) ALDH1A1MAPTMEN1KMT2AGAA
SCHEMBL2244779 0.73 SMN1; SMN2 (0.61) ALDH1A1MAPTMEN1KMT2AGAA
SCHEMBL9629186 0.73 SMN1; SMN2 (0.54) ALDH1A1MAPTMEN1KMT2AGAA
SCHEMBL2142002 0.73 ALDH1A1 (0.70) ALDH1A1MAPTMEN1KMT2AGAA

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
WO-2012004811-A1 PROCESS FOR THE PREPARATION OF 5-SUBSTSITUTED INDOLE DERIVATIVE IND-SWIFT LABORATORIES LIMITED (IN) 2012-01-12 — — WO disclosed
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