SCHEMBL4902115

SCHEMBL4902115

[O]C(=O)CCOc1cccc2ccccc12

nearest known ligand 0.60

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.60
ALDH1A1 P00352 3/20 0.60
HPGD P15428 3/20 0.60
TDP1 Q9NUW8 1/20 0.60
HTR1B P28222 10/20 0.59
KCNA3 P22001 1/20 0.56
HTR1D P28221 2/20 0.54
OGG1 O15527 1/20 0.54
SLC6A4 P31645 2/20 0.53
HRH1 P35367 1/20 0.53
TSHR P16473 1/20 0.51
ATM Q13315 1/20 0.51

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
SCHEMBL2925236 0.86 KDM4E (0.70) KDM4EALDH1A1HPGDTDP1HTR1B
SCHEMBL29865765 0.86 KDM4E (0.70) KDM4EALDH1A1HPGDTDP1HTR1B
SCHEMBL6331711 0.85 KDM4E (0.58) KDM4EALDH1A1HPGDTDP1HTR1B
SCHEMBL2925774 0.85 HTR1B (0.62) KDM4EALDH1A1HPGDTDP1HTR1B
SCHEMBL7278832 0.85 KDM4E (0.66) KDM4EALDH1A1HPGDTDP1HTR1B
SCHEMBL4908724 0.82 KDM4E (0.74) KDM4EALDH1A1HPGDTDP1HTR1B
SCHEMBL30600098 0.82 KDM4E (0.59) KDM4EALDH1A1HPGDTDP1HTR1B
SCHEMBL6676887 0.82 KDM4E (0.59) KDM4EALDH1A1HPGDTDP1HTR1B
SCHEMBL5488944 0.81 KDM4E (0.68) KDM4EALDH1A1HPGDTDP1HTR1B
SCHEMBL29865493 0.81 KDM4E (0.68) KDM4EALDH1A1HPGDTDP1HTR1B

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
US-20080107829-A1 Cellulose compound, cellulose film, optical compensation sheet, polarizing plate, and liquid crystal display device FUJIFILM CORPORATION (JP) 2008-05-08 US disclosed