SCHEMBL7799594

SCHEMBL7799594

C=C(C)C(=O)N(CC1CO1)C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.43

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
SCHEMBL17475489 0.84 ALDH1A1 (0.32) ALDH1A1
SCHEMBL17475556 0.84 ALDH1A1 (0.32) ALDH1A1
SCHEMBL508642 0.79 ALDH1A1 (0.52) ALDH1A1
SCHEMBL5133111 0.78 ALDH1A1 (0.46) ALDH1A1
SCHEMBL8036232 0.74 ALDH1A1 (0.39) ALDH1A1
SCHEMBL11983877 0.72 ALDH1A1 (0.38) ALDH1A1
SCHEMBL11218892 0.72 ALDH1A1 (0.41) ALDH1A1
SCHEMBL10705013 0.72 MEN1 (0.46) ALDH1A1
SCHEMBL6567358 0.71 ALDH1A1 (0.44) ALDH1A1
SCHEMBL4540857 0.70 ALDH1A1 (0.50) 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
EP-0951496-B1 ALKYD AND ARALKYD DERIVATIVES OF PHENOLIC POLYMERS GEORGIA PACIFIC RESINS (US) 2001-12-19 EP claimed