SCHEMBL4460908

SCHEMBL4460908

C=Cc1ccccc1C(C)C=CC

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.38
▸ MEN1 O00255 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ ATM Q13315 1/20 0.33

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
SCHEMBL27491151 0.82 ALDH1A1 (0.41) ALDH1A1
SCHEMBL1536702 0.78 ALDH1A1 (0.41) ALDH1A1
SCHEMBL31733666 0.78 ALDH1A1 (0.41) ALDH1A1
SCHEMBL50011 0.77 ALDH1A1 (0.44) ALDH1A1MEN1KMT2A
SCHEMBL56243 0.77 GABRA1 (0.44) ALDH1A1KMT2A
SCHEMBL6281523 0.77 ALDH1A1 (0.44) ALDH1A1MEN1KMT2A
SCHEMBL29364896 0.77 ALDH1A1 (0.44) ALDH1A1MEN1KMT2A
SCHEMBL29717597 0.77 GABRA1 (0.44) ALDH1A1KMT2A
SCHEMBL640982 0.75 ALDH1A1 (0.43) ALDH1A1MEN1KMT2A
SCHEMBL1507296 0.75 ALDH1A1 (0.48) 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-2009011753-A2 NANOSTRUCTURED POLYMER MEMBRANES FOR PROTON CONDUCTION THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2009-01-22 — — WO disclosed
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