SCHEMBL11199802

SCHEMBL11199802

C=C(C)C(=O)OC.CC(=CC=CC#N)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.47
PTGS1 P23219 1/20 0.36

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
Acrylic Acid Methyl Ester SCHEMBL5922663 0.89 ALDH1A1 (0.38) ALDH1A1
SCHEMBL793261 0.83 PTGS1 (0.48) ALDH1A1PTGS1
SCHEMBL5466031 0.83 ALDH1A1 (0.48) ALDH1A1
Acrylic Acid Methyl Ester SCHEMBL3229916 0.83 PTGS1 (0.37) ALDH1A1PTGS1
SCHEMBL680298 0.81 ALDH1A1 (0.33) ALDH1A1
SCHEMBL892355 0.81 ALDH1A1 (0.65) ALDH1A1PTGS1
SCHEMBL28053784 0.81 ALDH1A1 (0.65) ALDH1A1
SCHEMBL6817925 0.78 ALDH1A1 (0.38) ALDH1A1
SCHEMBL9250386 0.78 ALDH1A1 (0.50) ALDH1A1
Methacrylic Acid SCHEMBL9300136 0.76 ALDH1A1 (0.58) 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-0080042-A1 Method for the development of photoresist layers, and developer FUJI PHOTO FILM CO., LTD. (JP) 1983-06-01 EP disclosed