SCHEMBL24880834

SCHEMBL24880834

Cc1ccc(N2CCC3(CC2)OCCO3)c(F)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.46
SMN1; SMN2 Q16637 5/20 0.46
LMNA P02545 5/20 0.46
HPGD P15428 4/20 0.46
LGMN Q99538 1/20 0.44
GAA P10253 5/20 0.44
MAPT P10636 4/20 0.44
KDM4E B2RXH2 3/20 0.44
MAPK1 P28482 2/20 0.44
GLA P06280 1/20 0.44
HSD17B10 Q99714 1/20 0.44
HCRTR1 O43613 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
NPSR1 Q6W5P4 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
ATM Q13315 1/20 0.39

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
SCHEMBL14485084 0.84 NPC1 (0.52) ALDH1A1SMN1; SMN2LMNAHPGDLGMN
SCHEMBL14804169 0.83 LGMN (0.45) ALDH1A1SMN1; SMN2LMNAHPGDLGMN
SCHEMBL29931972 0.82 ATM (0.48) ALDH1A1SMN1; SMN2LMNAHPGDLGMN
SCHEMBL855383 0.82 ALDH1A1 (0.54) ALDH1A1SMN1; SMN2LMNAHPGDLGMN
SCHEMBL17543165 0.82 ATM (0.48) ALDH1A1SMN1; SMN2LMNAHPGDLGMN
SCHEMBL31312959 0.82 ALDH1A1 (0.54) ALDH1A1SMN1; SMN2LMNAHPGDLGMN
SCHEMBL27452092 0.82 SMN1; SMN2 (0.45) ALDH1A1SMN1; SMN2HPGDLGMNGAA
SCHEMBL17543650 0.81 POLB (0.48) ALDH1A1SMN1; SMN2LMNAHPGDLGMN
SCHEMBL25964567 0.81 ALDH1A1 (0.43) ALDH1A1SMN1; SMN2LMNAHPGDGAA
SCHEMBL12684501 0.80 MAPK8 (0.41) ALDH1A1SMN1; SMN2LMNAHPGDLGMN

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-2023280237-A1 SYNTHESIS AND APPLICATION OF PHOSPHATASE DEGRADER 海创药业股份有限公司 2023-01-12 WO disclosed