SCHEMBL14605474

SCHEMBL14605474

C=C/C(=C\N=C/C)C(C)=O

nearest known ligand 0.38

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.38

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
SCHEMBL20663364 0.82 LMNA (0.33) ALDH1A1
SCHEMBL14605398 0.80 ALDH1A1 (0.31) ALDH1A1
SCHEMBL17029326 0.77
SCHEMBL24784218 0.77
SCHEMBL3485148 0.75
SCHEMBL3437268 0.75
SCHEMBL19453303 0.71 ALDH1A1 (0.36) ALDH1A1
SCHEMBL13513205 0.70
SCHEMBL16541971 0.70
SCHEMBL19628819 0.70

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1926719-B1 2-ANILINE-4-ARYL SUBSTITUTED THIAZOLE DERIVATIVES JANSSEN PHARMACEUTICA NV (BE) 2017-05-31 EP disclosed
WO-2007031440-A2 2-ANILINE-4-ARYL SUBSTITUTED THIAZOLE DERIVATIVES JANSSEN PHARMACEUTICA N.V. (BE) 2007-03-22 WO disclosed