SCHEMBL8518270

SCHEMBL8518270

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

nearest known ligand 0.40

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 1/20 0.40
ALDH1A1 P00352 1/20 0.35
TSHR P16473 1/20 0.35
TET2 Q6N021 1/20 0.32

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
SCHEMBL15711292 0.77 GRIK1 (0.38) GRIK1ALDH1A1TSHR
SCHEMBL15711299 0.77 GRIK1 (0.38) GRIK1ALDH1A1TSHR
SCHEMBL9956486 0.75 GRIK1 (0.40) GRIK1ALDH1A1TSHR
SCHEMBL27285746 0.75 ALDH1A1 (0.30) ALDH1A1TSHR
SCHEMBL22811 0.73 GRIK1 (0.39) GRIK1ALDH1A1TSHR
SCHEMBL27166 0.73 GRIK1 (0.39) GRIK1ALDH1A1TSHR
SCHEMBL9257272 0.71 GABRR1 (0.39) GRIK1ALDH1A1TSHR
SCHEMBL9257276 0.71 GABRR1 (0.39) GRIK1ALDH1A1TSHR
SCHEMBL2222065 0.71 GABRR1 (0.39) GRIK1ALDH1A1TSHR
SCHEMBL5408157 0.71 GRIK1 (0.38) GRIK1ALDH1A1TSHR

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
US-5973094-A Functional polymers WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 1999-10-26 US disclosed
EP-0794199-A2 Novel functional polymers WAKO PURE CHEMICAL INDUSTRIES, LTD (JP) 1997-09-10 EP disclosed