Pivalate

Pivalate

SCHEMBL28053669

CC(C)(C)C(=O)O.CC1(C)CNCCN1

nearest known ligand 0.30

Full drug profile on Sugi Atlas →

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALPL P05186 1/20 0.30
ALDH1A1 P00352 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
Acetic Acid SCHEMBL1871815 0.85 ALPL (0.33) ALPL
Oxalic Acid SCHEMBL21436329 0.85 ALPL (0.33) ALPL
Succinic Acid SCHEMBL21436621 0.79 EGLN1 (0.38) ALPL
Fumaric Acid SCHEMBL21436601 0.79 TSHR (0.38) ALPLALDH1A1
SCHEMBL64209 0.79
Cadaverine Tartrate SCHEMBL21436357 0.78 TSHR (0.40)
Hydrochloric Acid SCHEMBL3832428 0.77 ALPL (0.40) ALPL
Ammonia Solution, Strong SCHEMBL21436559 0.77
Hydrochloric Acid SCHEMBL14335493 0.77
Pivalate SCHEMBL27543436 0.77 TSHR (0.42) ALDH1A1SMN1; SMN2

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-105358151-A Compounds for treating spinal muscular atrophy HOFFMANN LA ROCHE 2016-02-24 CN disclosed