SCHEMBL27484010

SCHEMBL27484010

CCOC(=O)C1OC1C(=O)NCCC(=O)N1CCN(c2ccccc2Cl)CC1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GFER P55789 1/20 0.50
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
HTR7 P34969 1/20 0.44
TSHR P16473 4/20 0.43
MAPT P10636 3/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
GAA P10253 3/20 0.43
NPSR1 Q6W5P4 1/20 0.43
GRM5 P41594 1/20 0.43
HSD17B10 Q99714 1/20 0.43
ALDH1A1 P00352 3/20 0.43
KDM4E B2RXH2 1/20 0.42
HTT P42858 1/20 0.42

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
SCHEMBL27498857 0.90 ALDH1A1 (0.45) MEN1KMT2ATSHRMAPTSMN1; SMN2
SCHEMBL6978355 0.86 GFER (0.55) GFERMEN1KMT2AHTR7TSHR
SCHEMBL6978349 0.86 GFER (0.55) GFERMEN1KMT2AHTR7TSHR
SCHEMBL6978386 0.75 KMT2A (0.49) GFERMEN1KMT2AHTR7TSHR
SCHEMBL6978390 0.75 KMT2A (0.49) GFERMEN1KMT2AHTR7TSHR
SCHEMBL1376551 0.75 KMT2A (0.53) MEN1KMT2AHTR7TSHRMAPT
SCHEMBL1375794 0.75 KMT2A (0.53) MEN1KMT2AHTR7TSHRMAPT
SCHEMBL6981156 0.71 DRD3 (0.44) GFERHTR7MAPTNPSR1ALDH1A1
SCHEMBL2165481 0.70 ALDH1A1 (0.67) MEN1KMT2ATSHRMAPTSMN1; SMN2
SCHEMBL6978571 0.70 KMT2A (0.44) MEN1KMT2AHTR7TSHRMAPT

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-1195343-A Piperazine derivatives and use of same SENJU PHARMA CO (JP) 1998-10-07 CN disclosed
CN-1163145-A Inhibiting agent for vascular formation SENJI SEIYAKU K K (JP) 1997-10-29 CN disclosed