SCHEMBL28079757

SCHEMBL28079757

CCC(=O)OC(C)(C)CCl

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33
NAAA Q02083 1/20 0.31

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
SCHEMBL4839421 0.80 ALDH1A1 (0.36) ALDH1A1NAAA
SCHEMBL119952 0.80 ALDH1A1 (0.36) ALDH1A1NAAA
SCHEMBL2380925 0.80 ALDH1A1 (0.39) ALDH1A1NAAA
SCHEMBL17580217 0.79 KDM4E (0.30)
SCHEMBL9635053 0.78 ALDH1A1 (0.35) ALDH1A1NAAA
Ethane SCHEMBL28422864 0.78 ALDH1A1 (0.38) ALDH1A1NAAA
SCHEMBL9574576 0.77 GAA (0.46)
SCHEMBL872465 0.77 GAA (0.32)
SCHEMBL130308 0.76 ALDH1A1 (0.33) ALDH1A1NAAA
SCHEMBL11696278 0.76 KDM4E (0.33) ALDH1A1NAAA

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
CN-105683155-A Novel diamine, polyamic acid, and polyimide 日产化学工业株式会社 2016-06-15 CN disclosed