SCHEMBL25604176

SCHEMBL25604176

CCCC(CNC=O)C(C)C

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ADH1B P00325 5/20 0.50
ADH1A P07327 5/20 0.50
ADH1C P00326 4/20 0.50
ADH7 P40394 4/20 0.41
ADH4 P08319 2/20 0.37
EPHX1 P07099 1/20 0.37
KDM4E B2RXH2 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
SCHEMBL28146905 0.88 ADH1B (0.46) ADH1BADH1AADH1CADH7ADH4
SCHEMBL28183645 0.83 ADH1B (0.56) ADH1BADH1AADH1CADH7
SCHEMBL20374329 0.79 KDM4E (0.33) KDM4E
SCHEMBL5932572 0.79 TSHR (0.37)
SCHEMBL269153 0.77
SCHEMBL8628353 0.75 ADH1B (0.50) ADH1BADH1AADH1CADH7ADH4
SCHEMBL13950294 0.75 ADH1B (0.50) ADH1BADH1AADH1CADH7ADH4
SCHEMBL21337905 0.73 ANPEP (0.36)
SCHEMBL20860996 0.72 ADH1B (0.43) ADH1BADH1AADH1CADH7ADH4
SCHEMBL19775199 0.72 TSHR (0.31)

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-3724188-B1 PROGRANULIN MODULATORS AND METHODS OF USING THE SAME ARKUDA THERAPEUTICS (US) 2023-06-07 EP disclosed