SCHEMBL5356898

SCHEMBL5356898

COCCOCCOCCOC(=O)CCC(=O)CN

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 1/20 0.56
KDM4E B2RXH2 1/20 0.53
LMNA P02545 1/20 0.53
ADRA2A P08913 1/20 0.38
ADRA1A P35348 1/20 0.38
GABRR1 P24046 1/20 0.38
MAPT P10636 1/20 0.37
BLM P54132 1/20 0.37
DGKA P23743 1/20 0.36
TSHR P16473 5/20 0.33
CA2 P00918 1/20 0.33
CYP1A2 P05177 1/20 0.32
ABCB11 O95342 1/20 0.32
CYP3A4 P08684 1/20 0.32
ADRA2B P18089 1/20 0.32
OPRD1 P41143 1/20 0.32
SCN5A Q14524 1/20 0.32
TDP1 Q9NUW8 1/20 0.31
ALDH1A1 P00352 3/20 0.31
TP53 P04637 2/20 0.31

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
Hydrochloric Acid SCHEMBL4492210 0.98 KDM4E (0.56) HTR2CKDM4ELMNAADRA2AADRA1A
SCHEMBL3393178 0.94 HTR2C (0.61) HTR2CKDM4ELMNAADRA2AADRA1A
Hydrochloric Acid SCHEMBL4487208 0.93 KDM4E (0.62) HTR2CKDM4ELMNAADRA2AADRA1A
SCHEMBL13268865 0.87 ADRA2A (0.48) HTR2CADRA2AADRA1AMAPTBLM
SCHEMBL2302053 0.87 ADRA2A (0.48) HTR2CADRA2AADRA1AMAPTBLM
SCHEMBL22510580 0.87 ADRA2A (0.48) HTR2CADRA2AADRA1AMAPTBLM
SCHEMBL3393335 0.86 HTR2C (0.60) HTR2CKDM4ELMNAADRA2AADRA1A
SCHEMBL13098013 0.84 HTR2C (0.66) HTR2CKDM4ELMNAADRA2AADRA1A
Hydrochloric Acid SCHEMBL1177554 0.84 HTR2C (0.58) HTR2CKDM4ELMNAADRA2AADRA1A
SCHEMBL3819574 0.84 HTR2C (0.62) HTR2CKDM4ELMNAADRA2AADRA1A

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-7287646-B2 Esters of 5-aminolevulinic acid and their use as photosensitizing compounds in photochemotherapy PHOTOCURE ASA (NO) 2007-10-30 US claimed
US-20050107471-A1 NEW ESTERS OF 5-AMINOLEVULINIC ACID AND THEIR USE AS PHOTOSENSITIZING COMPOUNDS IN PHOTOCHEMOTHERAPY GIERSKCKY KARL E (NO) 2005-05-19 US claimed