SCHEMBL24677567

SCHEMBL24677567

CC(N)c1ccc(CNC=O)cc1

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ADH1B P00325 2/20 0.52
ADH1C P00326 2/20 0.52
ADH1A P07327 2/20 0.52
ADH7 P40394 1/20 0.52
ADRB2 P07550 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.37
BACE1 P56817 1/20 0.35
PDE2A O00408 1/20 0.34
MEN1 O00255 2/20 0.34
RAB9A P51151 2/20 0.34
KMT2A Q03164 2/20 0.34
ROCK2 O75116 2/20 0.34
ROCK1 Q13464 2/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
NPC1 O15118 1/20 0.33
F2 P00734 1/20 0.33
ITGB1 P05556 1/20 0.33
ITGA5 P08648 1/20 0.33
TAAR1 Q96RJ0 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
SCHEMBL17503936 1.00 ADH1B (0.52) ADH1BADH1CADH1AADH7ADRB2
SCHEMBL3307130 0.85 ADH1B (0.55) ADH1BADH1CADH1AADH7L3MBTL1
SCHEMBL8763196 0.79 ADH1B (0.76) ADH1BADH1CADH1AADH7MEN1
SCHEMBL6720044 0.78 ADH1B (0.52) ADH1BADH1CADH1AADH7L3MBTL1
SCHEMBL11304055 0.77 ADH1B (0.55) ADH1BADH1CADH1AADH7MEN1
SCHEMBL17503962 0.74 ADH1B (0.61) ADH1BADH1CADH1AADH7
SCHEMBL43651 0.74 ADH1B (0.61) ADH1BADH1CADH1AADH7ITGB1
SCHEMBL4633463 0.74 ADH1B (0.61) ADH1BADH1CADH1AADH7L3MBTL1
SCHEMBL31566 0.74 ADH1B (0.61) ADH1BADH1CADH1AADH7L3MBTL1
SCHEMBL8763263 0.73 ADH1B (0.67) ADH1BADH1CADH1AADH7KMT2A

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
WO-2022178030-A1 TRPM8 AGONISTS AS COOLING AGENTS AND FOR THE TREATMENT OF DISEASE Concentric Analgesics, Inc. (US) 2022-08-25 WO disclosed