SCHEMBL7987570

SCHEMBL7987570

COc1cc(/C=N/N=C(/CSc2cc(C)nc3ccccc23)OC(C)=O)cc(OC)c1OC

nearest known ligand 0.67

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.52

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
SCHEMBL7996729 0.80 ALDH1A1 (0.76) ALDH1A1
SCHEMBL8001294 0.80 ALDH1A1 (0.53) ALDH1A1
SCHEMBL2977982 0.71 ALDH1A1 (0.76) ALDH1A1
SCHEMBL2977980 0.71 ALDH1A1 (0.76) ALDH1A1
Hydrochloric Acid SCHEMBL944140 0.70 — —
Hydrochloric Acid SCHEMBL944142 0.70 — —
SCHEMBL943064 0.70 ALDH1A1 (0.71) ALDH1A1
SCHEMBL4304271 0.69 ALDH1A1 (0.53) ALDH1A1
SCHEMBL4316163 0.65 GAA (0.72) ALDH1A1
SCHEMBL8089833 0.64 PPARG (0.57) ALDH1A1

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-2009143178-A2 PDE10 INHIBITORS AND RELATED COMPOSITIONS AND METHODS OMEROS CORPORATION (US) 2009-11-26 — — WO disclosed
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