SCHEMBL27176406

SCHEMBL27176406

CC(O)C(c1cccnc1)c1ccccn1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 6/20 0.54
SMN1; SMN2 Q16637 2/20 0.49
GAA P10253 1/20 0.45
SLC6A2 P23975 2/20 0.43
SLC6A4 P31645 2/20 0.43
SLC6A3 Q01959 2/20 0.43
CFTR P13569 1/20 0.43
GOPC Q9HD26 1/20 0.43
KDM4E B2RXH2 1/20 0.43
KCND3 Q9UK17 1/20 0.42
CYP1A2 P05177 2/20 0.41
CYP3A4 P08684 1/20 0.41
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40

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
SCHEMBL27176402 0.82 SMN1; SMN2 (0.61) KCNA5SMN1; SMN2GAASLC6A2SLC6A4
SCHEMBL30326956 0.82 SMN1; SMN2 (0.61) KCNA5SMN1; SMN2GAASLC6A2SLC6A4
SCHEMBL4120932 0.81 SMN1; SMN2 (0.45) KCNA5SMN1; SMN2GAASLC6A2SLC6A4
SCHEMBL6585155 0.80 SLC6A2 (0.48) KCNA5SMN1; SMN2GAASLC6A2SLC6A4
SCHEMBL22645056 0.79 SLC6A2 (0.47) KCNA5SMN1; SMN2GAASLC6A2SLC6A4
SCHEMBL29112655 0.76 KDM4E (0.46) KCNA5SMN1; SMN2GAASLC6A2SLC6A4
SCHEMBL5386880 0.76 SMN1; SMN2 (0.53) KCNA5SMN1; SMN2GAASLC6A2SLC6A4
SCHEMBL1381154 0.76 KCNA5 (0.55) KCNA5SMN1; SMN2SLC6A2SLC6A4SLC6A3
SCHEMBL20465414 0.75 KCNA5 (0.45) KCNA5SMN1; SMN2GAASLC6A2SLC6A4
SCHEMBL18400269 0.75 KCNA5 (0.45) KCNA5SMN1; SMN2GAASLC6A2SLC6A4

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-4341261-A1 AXL COMPOUNDS Arcus Biosciences, Inc. (US) 2024-03-27 EP disclosed