SCHEMBL29448052

SCHEMBL29448052

CCC1(CC)Cc2ccccc2C1=O

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 3/20 0.64
LMNA P02545 2/20 0.64
HTT P42858 1/20 0.64
L3MBTL1 Q9Y468 1/20 0.64
PRNP P04156 2/20 0.52
ALDH1A1 P00352 7/20 0.51
TSHR P16473 1/20 0.51
KDM4E B2RXH2 4/20 0.47
GAA P10253 3/20 0.47
KMT2A Q03164 3/20 0.46
MEN1 O00255 2/20 0.46
GLA P06280 2/20 0.43
HPGD P15428 2/20 0.43
PPARG P37231 1/20 0.42
RXFP1 Q9HBX9 1/20 0.42
NR2E3 Q9Y5X4 1/20 0.42
NCOR2 Q9Y618 1/20 0.42
HTR2A P28223 2/20 0.40
HTR2C P28335 2/20 0.40
HTR2B P41595 2/20 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
SCHEMBL9172913 1.00 NPSR1 (0.64) NPSR1LMNAHTTL3MBTL1PRNP
SCHEMBL13253339 0.90 NPSR1 (0.57) NPSR1LMNAHTTL3MBTL1PRNP
SCHEMBL11931712 0.83 LMNA (0.54) NPSR1LMNAHTTL3MBTL1PRNP
SCHEMBL6904284 0.81 LMNA (0.64) NPSR1LMNAHTTL3MBTL1PRNP
SCHEMBL15630925 0.81 LMNA (0.64) NPSR1LMNAHTTL3MBTL1PRNP
SCHEMBL11528017 0.79 KDM4E (0.63) NPSR1LMNAHTTL3MBTL1PRNP
SCHEMBL9286065 0.78 LMNA (0.65) NPSR1LMNAHTTL3MBTL1PRNP
SCHEMBL28802227 0.78 NPSR1 (1.00) NPSR1LMNAHTTL3MBTL1PRNP
SCHEMBL27955063 0.77 ALDH1A1 (0.51) NPSR1LMNAHTTL3MBTL1PRNP
SCHEMBL23361906 0.75 TDP2 (0.42) NPSR1LMNAHTTL3MBTL1PRNP

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-114262250-A Synthetic method of aromatic ring benzyl ortho-position dialkyl 乐威医药(江苏)股份有限公司 2022-04-01 CN disclosed