SCHEMBL13321995

SCHEMBL13321995

CCOC(OCC)(P=O)c1c2ccccc2c(CP(=O)(OCC)OCC)c2ccccc12

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ NPY5R Q15761 1/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.32
▸ KCNH2 Q12809 1/20 0.31
▸ MAPT P10636 2/20 0.31
▸ NR1I2 O75469 1/20 0.31
▸ HTT P42858 1/20 0.30
▸ MAPK1 P28482 1/20 0.30
▸ PSEN1 P49768 1/20 0.30
▸ PSEN2 P49810 1/20 0.30
▸ APH1B Q8WW43 1/20 0.30
▸ NCSTN Q92542 1/20 0.30
▸ APH1A Q96BI3 1/20 0.30
▸ PSENEN Q9NZ42 1/20 0.30
▸ POLB P06746 1/20 0.30
▸ ACHE P22303 1/20 0.30

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
SCHEMBL1305525 0.81 KDM4E (0.45) KDM4ELMNAHPGDNPY5RNPSR1
SCHEMBL6305102 0.74 KDM4E (0.41) KDM4ELMNAHPGDNPY5RNPSR1
SCHEMBL916643 0.71 NR1I2 (0.52) KDM4ELMNAHPGDNPY5RNPSR1
SCHEMBL13387363 0.70 NPY5R (0.52) KDM4ELMNAHPGDNPY5RNPSR1
SCHEMBL11751939 0.67 KDM4E (0.44) KDM4ELMNAHPGDNPY5RNPSR1
SCHEMBL14558950 0.65 NPY5R (0.32) NPY5R
SCHEMBL4631824 0.65 EGFR (0.30) —
SCHEMBL14558948 0.65 HDAC1 (0.32) NPY5R
SCHEMBL28205756 0.65 KCNN4 (0.36) KDM4ELMNAMAPK1POLB
SCHEMBL702504 0.64 NPSR1 (0.47) KDM4ELMNAHPGDNPSR1KCNH2

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-7718760-B2 π-Conjugated polymer and manufacturing method thereof RICOH COMPANY, LTD. (JP) 2010-05-18 — — US disclosed
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