SCHEMBL28009986

SCHEMBL28009986

CC(N(C)C)C(C)(C(=O)O)N(C)C

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33
TSHR P16473 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
SCHEMBL29112562 0.80 ALDH1A1 (0.36) ALDH1A1TSHR
SCHEMBL1282705 0.78 TP53 (0.35) ALDH1A1TSHR
SCHEMBL1282706 0.78 TP53 (0.35) ALDH1A1TSHR
SCHEMBL27466001 0.76 ALDH1A1 (0.34) ALDH1A1TSHR
SCHEMBL27936310 0.76 ALDH1A1 (0.33) ALDH1A1TSHR
SCHEMBL27913441 0.75 ALDH1A1 (0.36) ALDH1A1TSHR
SCHEMBL29112582 0.73 TSHR (0.31) ALDH1A1TSHR
SCHEMBL29012646 0.71
SCHEMBL27786289 0.71
SCHEMBL27436534 0.71

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-102596947-B Crystal form of sulfonylurea compound and process for producing the same NISSAN CHEMICAL IND LTD 2015-05-27 CN disclosed