SCHEMBL30952890

SCHEMBL30952890

Cc1nc2cc3nc(C(C)(C)O)c(N)cc3cc2o1

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
GAA P10253 1/20 0.34
CHRNB2 P17787 1/20 0.34
CHRNA4 P43681 1/20 0.34
POLB P06746 2/20 0.33
ALDH1A1 P00352 1/20 0.33
NPC1 O15118 3/20 0.32
RAB9A P51151 3/20 0.32
STAT1 P42224 1/20 0.32
TERT O14746 1/20 0.31
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
MAPT P10636 1/20 0.31
KMT2A Q03164 1/20 0.31
GFER P55789 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
SCHEMBL23626191 1.00 SMN1; SMN2 (0.34) SMN1; SMN2L3MBTL1GAACHRNB2CHRNA4
SCHEMBL23625934 0.77 CYP2D6 (0.32)
SCHEMBL25995484 0.77 L3MBTL1 (0.38) SMN1; SMN2L3MBTL1GAACHRNB2CHRNA4
SCHEMBL24961373 0.76 CNR2 (0.43)
SCHEMBL30040347 0.76 CNR2 (0.43)
SCHEMBL28765821 0.74 SMN1; SMN2 (0.39) SMN1; SMN2L3MBTL1GAACHRNB2CHRNA4
SCHEMBL24823325 0.74
SCHEMBL30310958 0.74
SCHEMBL30195000 0.74 L3MBTL1 (0.36) SMN1; SMN2L3MBTL1GAACHRNB2CHRNA4
SCHEMBL30040160 0.71 CNR2 (0.41)

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
CN-113767090-B Tricyclic compound, preparation method and medical application thereof 中国医药研究开发中心有限公司 2024-05-28 CN disclosed