SCHEMBL24596177

SCHEMBL24596177

Cc1ncn(Cc2cnn(C)c2)c1C

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GRIN2B Q13224 6/20 0.40
KCNH2 Q12809 3/20 0.39
GABRA1 P14867 1/20 0.37
GABRA5 P31644 1/20 0.37
SCN2A Q99250 1/20 0.36
CECR2 Q9BXF3 1/20 0.36
BAZ2B Q9UIF8 1/20 0.36
BAZ2A Q9UIF9 1/20 0.36
FDPS P14324 1/20 0.36
GRIN1 Q05586 4/20 0.35
TLR7 Q9NYK1 2/20 0.34
PDE10A Q9Y233 1/20 0.34
CACNA2D1 P54289 1/20 0.33
SCN5A Q14524 1/20 0.33
SCN9A Q15858 1/20 0.33
MET P08581 1/20 0.33
DRD2 P14416 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
SCHEMBL30628842 0.67 KCNH2 (0.43) KCNH2GABRA1GABRA5PDE10A
SCHEMBL20011271 0.66 FDPS (0.44) FDPS
SCHEMBL8342570 0.66
SCHEMBL178438 0.65
SCHEMBL11745655 0.65
SCHEMBL28701456 0.65 RAB9A (0.41) GRIN2BKCNH2SCN5ASCN9A
SCHEMBL13403286 0.65 FDPS (0.43) FDPS
SCHEMBL23750087 0.65 CHRNB2 (0.51) GRIN2BKCNH2GABRA1GABRA5DRD2
SCHEMBL18390904 0.65 MC4R (0.53) KCNH2DRD2
SCHEMBL31010164 0.65 HRH3 (0.52) KCNH2DRD2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4273146-A1 TRICYCLIC COMPOUND AND USE THEREOF Nanjing Zaiming Pharmaceutical Co., Ltd. (CN) 2023-11-08 EP disclosed
WO-2022143864-A1 TRICYCLIC COMPOUND AND USE THEREOF 江苏先声药业有限公司 2022-07-07 WO disclosed