SCHEMBL30097629

SCHEMBL30097629

CN(C(=O)c1cc(Cl)cc(Nc2ccccc2F)n1)c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GPBAR1 Q8TDU6 4/20 0.40
POLB P06746 2/20 0.39
MAPT P10636 3/20 0.39
RECQL P46063 1/20 0.39
MAPK8 P45983 1/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
SIRT2 Q8IXJ6 1/20 0.37
AURKA O14965 1/20 0.37
PLAU P00749 1/20 0.37
KDM4E B2RXH2 1/20 0.36
KMT2A Q03164 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36

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
SCHEMBL23413303 1.00 GPBAR1 (0.40) GPBAR1POLBMAPTRECQLMAPK8
SCHEMBL23413305 0.87 MAPT (0.46) GPBAR1POLBMAPTMAPK8SMN1; SMN2
SCHEMBL30097705 0.87 MAPT (0.46) GPBAR1POLBMAPTMAPK8SMN1; SMN2
SCHEMBL30097478 0.86 SIRT2 (0.40) MAPTRECQLMAPK8SMN1; SMN2SIRT2
SCHEMBL23413363 0.86 SIRT2 (0.40) MAPTRECQLMAPK8SMN1; SMN2SIRT2
SCHEMBL23412641 0.84 MAPT (0.46) GPBAR1MAPTSMN1; SMN2AURKAKDM4E
SCHEMBL30097572 0.84 MAPT (0.46) GPBAR1MAPTSMN1; SMN2AURKAKDM4E
SCHEMBL23413114 0.84 MAPT (0.40) MAPTRECQLMAPK8SMN1; SMN2SIRT2
SCHEMBL23413164 0.82 ABCC1 (0.44) GPBAR1POLBMAPTMAPK8SMN1; SMN2
SCHEMBL30097700 0.82 ABCC1 (0.44) GPBAR1POLBMAPTMAPK8SMN1; SMN2

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
CN-115348959-B Heteroaryl compounds and their therapeutic use in conditions associated with altered beta-glucocerebrosidase activity GT增益治疗股份有限公司 2025-01-07 CN disclosed
CN-115348959-A Heteroaryl compounds and their therapeutic use in disorders associated with altered beta-glucocerebrosidase activity 增益治疗股份有限公司 2022-11-15 CN disclosed