SCHEMBL26426440

SCHEMBL26426440

CCCC(C)(NC=O)C(C)C

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ADH1B P00325 5/20 0.36
ADH1A P07327 5/20 0.36
ADH7 P40394 4/20 0.36
ADH1C P00326 4/20 0.33
ADH4 P08319 2/20 0.32
EPHX1 P07099 1/20 0.32
PKM P14618 1/20 0.31
CTSK P43235 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
SCHEMBL276680 0.82 ADH1B (0.36) ADH1BADH1AADH7ADH1CADH4
SCHEMBL5933547 0.74
SCHEMBL14510005 0.72
SCHEMBL8626674 0.72 ADH1B (0.36) ADH1BADH1AADH7ADH1CADH4
SCHEMBL269676 0.72
SCHEMBL15314498 0.72
SCHEMBL15314499 0.70
SCHEMBL14072955 0.70
SCHEMBL8629305 0.69 ADH1B (0.38) ADH1BADH1AADH7ADH1CADH4
SCHEMBL20193790 0.67 ALDH1A1 (0.33)

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-4169913-A1 SUBSTITUTED PYRAZINE COMPOUND, PHARMACEUTICAL COMPOSITION COMPRISING SAME, AND USE THEREOF Sichuan Kelun-Biotech Biopharmaceutical Co., Ltd. (CN) 2023-04-26 EP disclosed