SCHEMBL28536825

SCHEMBL28536825

CCOC(=O)N1CC=Cc2cccnc21

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.39
FAAH O00519 1/20 0.39
MGLL Q99685 1/20 0.39
NOS2 P35228 1/20 0.38
GPR119 Q8TDV5 1/20 0.38
KDM4E B2RXH2 3/20 0.38
ALDH1A1 P00352 3/20 0.38
MAPT P10636 1/20 0.37
MPI P34949 1/20 0.37
KMT2A Q03164 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
HTR3E A5X5Y0 1/20 0.37
HTR3B O95264 1/20 0.37
HTR3A P46098 1/20 0.37
HTR3D Q70Z44 1/20 0.37
HTR3C Q8WXA8 1/20 0.37
TP53 P04637 1/20 0.37
HPGD P15428 1/20 0.37
HTT P42858 1/20 0.37

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
SCHEMBL4064728 0.83 MAPT (0.40) LMNAGPR119KDM4EALDH1A1MAPT
SCHEMBL852448 0.83 POLB (0.43) GPR119POLB
SCHEMBL30511570 0.79 PARP1 (0.36) LMNAKDM4EMAPTKMT2ATP53
SCHEMBL1836164 0.79 PARP1 (0.36) LMNAKDM4EMAPTKMT2ATP53
SCHEMBL29106412 0.79 SMN1; SMN2 (0.33) LMNAMAPTKMT2ATP53
SCHEMBL29549990 0.77 SMN1; SMN2 (0.53) LMNAALDH1A1MAPTKMT2AL3MBTL1
SCHEMBL205655 0.77 SMN1; SMN2 (0.53) LMNAALDH1A1MAPTKMT2AL3MBTL1
Hydrochloric Acid SCHEMBL29106429 0.77 SMN1; SMN2 (0.33) LMNAKMT2ATP53
SCHEMBL7051387 0.71 SMN1; SMN2 (0.36) LMNAHTR3ATP53HRH1CYP2C19
SCHEMBL31503999 0.70 GSK3A (0.44) LMNAKDM4EALDH1A1MAPTKMT2A

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107205993-B Organic compounds 细胞内治疗公司 2021-03-09 CN claimed
CN-107849040-B Tricyclic derivative compound, preparation method thereof, and pharmaceutical composition containing the same 肿瘤学治疗公司 2021-04-06 CN disclosed
CN-107205993-B Organic compounds 细胞内治疗公司 2021-03-09 CN disclosed
CN-100441579-C Tetrahydronaphthyridine derivatives as cholesteryl ester transfer protein inhibitors TANABE SEIYAKU CO (JP) 2008-12-10 CN disclosed
CN-1938301-A Tetrahydronaphthyridine derivatives as cholesteryl ester transfer protein inhibitors TANABE SEIYAKU CO (JP) 2007-03-28 CN disclosed