SCHEMBL9818210

SCHEMBL9818210

O=[C]CCCc1cc(Cl)c(Cl)c(Cl)c1

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.33
IGF1R P08069 1/20 0.32
ALOX15 P16050 1/20 0.32
CYP3A4 P08684 1/20 0.31
HPGD P15428 1/20 0.31
CRHBP P24387 1/20 0.31
CRHR2 Q13324 1/20 0.31
HSD17B10 Q99714 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
SCHEMBL11199932 0.92 IGF1R (0.33) ALDH1A1IGF1RALOX15
SCHEMBL5544401 0.80 IGF1R (0.53) ALDH1A1IGF1RALOX15
SCHEMBL5545863 0.75 IGF1R (0.56) ALDH1A1IGF1RALOX15
SCHEMBL5539473 0.73 IGF1R (0.54) ALDH1A1IGF1RALOX15
SCHEMBL9818299 0.73 ALDH1A1 (0.39) ALDH1A1CYP3A4HPGDCRHBPCRHR2
SCHEMBL3741298 0.72 TAAR1 (0.46) IGF1RALOX15
SCHEMBL9026650 0.72 IGF1R (0.36) ALDH1A1IGF1RALOX15CYP3A4HPGD
SCHEMBL12474302 0.71 ALDH1A1 (0.38) ALDH1A1IGF1RALOX15CYP3A4HPGD
SCHEMBL28404106 0.71 HPGD (0.48) ALDH1A1CYP3A4HPGDHSD17B10
SCHEMBL3739458 0.71 SKP2 (0.32) HPGD

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
EP-0126635-B1 NOVEL OXINDOLE DERIVATIVE OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1991-12-18 EP disclosed
US-4694017-A 2-amido 3(oxindol-3-yl)propionic acids having antiulcer activity OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1987-09-15 US disclosed
EP-0126635-A2 Novel oxindole derivative OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1984-11-28 EP disclosed