SCHEMBL29246741

SCHEMBL29246741

CCCCCOc1cc(OCCCCC)c(C=O)cc1Br

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 6/20 0.47
LMNA P02545 1/20 0.46
THRA P10827 4/20 0.41
THRB P10828 4/20 0.41
S1PR2 O95136 1/20 0.41
S1PR1 P21453 1/20 0.41
S1PR3 Q99500 1/20 0.41
LPAR2 Q9HBW0 1/20 0.41
KDM4E B2RXH2 2/20 0.40
MEN1 O00255 1/20 0.40
GAA P10253 1/20 0.40
KMT2A Q03164 1/20 0.40
PRKDC P78527 1/20 0.39
ALDH1A1 P00352 1/20 0.38
TSHR P16473 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
PTGDR2 Q9Y5Y4 1/20 0.38

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
SCHEMBL30584237 1.00 PTPN1 (0.47) PTPN1LMNATHRATHRBS1PR2
SCHEMBL14048033 0.95 PTPN1 (0.51) PTPN1LMNATHRATHRBKDM4E
SCHEMBL29771722 0.95 PTPN1 (0.51) PTPN1LMNATHRATHRBKDM4E
SCHEMBL2037716 0.94 LMNA (0.54) PTPN1LMNATHRATHRBS1PR2
SCHEMBL2038528 0.92 LMNA (0.53) PTPN1LMNATHRATHRBS1PR2
SCHEMBL2040993 0.92 LMNA (0.53) PTPN1LMNATHRATHRBS1PR2
SCHEMBL2037034 0.92 LMNA (0.53) PTPN1LMNATHRATHRBS1PR2
SCHEMBL29771743 0.90 LMNA (0.49) PTPN1LMNAKDM4EMEN1GAA
SCHEMBL29246738 0.90 LMNA (0.49) PTPN1LMNAKDM4EMEN1GAA
SCHEMBL2037945 0.89 LMNA (0.56) PTPN1LMNATHRATHRBKDM4E

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-114853652-B Sulfonium salt compound, preparation method and application thereof, and cationic UV (ultraviolet) curing adhesive 韦尔通科技股份有限公司 2023-08-29 CN disclosed