SCHEMBL9863801

SCHEMBL9863801

CC(O)COC(C)COCC1CCCO1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.44
PRMT5 O14744 1/20 0.41
WDR77 Q9BQA1 1/20 0.41
DRD2 P14416 1/20 0.39
HTR2A P28223 1/20 0.39
HRH1 P35367 1/20 0.39
LMNA P02545 2/20 0.39
POLB P06746 1/20 0.39
ALDH1A1 P00352 1/20 0.37
HPGD P15428 1/20 0.35
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
NPSR1 Q6W5P4 1/20 0.33
KDM4E B2RXH2 2/20 0.33
ADRB2 P07550 1/20 0.33
HTT P42858 1/20 0.32

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
SCHEMBL9863674 0.98 TDP1 (0.42) TDP1PRMT5WDR77DRD2HTR2A
SCHEMBL10781866 0.98 TDP1 (0.42) TDP1PRMT5WDR77DRD2HTR2A
SCHEMBL9864444 0.98 TDP1 (0.42) TDP1PRMT5WDR77DRD2HTR2A
SCHEMBL9863870 0.98 TDP1 (0.42) TDP1PRMT5WDR77DRD2HTR2A
SCHEMBL9863774 0.93 TDP1 (0.47) TDP1PRMT5WDR77DRD2HTR2A
SCHEMBL9863576 0.92 TDP1 (0.46) TDP1PRMT5WDR77DRD2HTR2A
SCHEMBL9876569 0.92 TDP1 (0.46) TDP1PRMT5WDR77DRD2HTR2A
SCHEMBL9863994 0.92 TDP1 (0.46) TDP1PRMT5WDR77DRD2HTR2A
SCHEMBL9863593 0.90 TDP1 (0.45) TDP1PRMT5WDR77DRD2HTR2A
SCHEMBL4983254 0.89 PRMT5 (0.45) TDP1PRMT5WDR77DRD2HTR2A

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
US-5015524-A Lens sheet MITSUBISHI RAYON COMPANY, LTD. (JP) 1991-05-14 US disclosed
EP-0376254-A2 Lens sheet MITSUBISHI RAYON CO., LTD. (JP) 1990-07-04 EP disclosed