SCHEMBL27583182

SCHEMBL27583182

CC=C(O)C(=CC)OCCCCCC

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 2/20 0.47
NAAA Q02083 1/20 0.45
CA12 O43570 3/20 0.44
CA1 P00915 3/20 0.44
CA2 P00918 3/20 0.44
CA9 Q16790 3/20 0.44
EPHX1 P07099 1/20 0.42
TSHR P16473 3/20 0.41
RAD52 P43351 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
FAAH O00519 1/20 0.38
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
ATM Q13315 1/20 0.38
MEN1 O00255 1/20 0.38
THRB P10828 1/20 0.38
HTT P42858 1/20 0.38
KMT2A Q03164 1/20 0.38
MAPT P10636 1/20 0.38
ACHE P22303 2/20 0.37

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
SCHEMBL27485572 0.91 ATM (0.45) HCAR2NAAACA12CA1CA2
SCHEMBL898555 0.79 HCAR2 (0.53) HCAR2NAAACA12CA1CA2
SCHEMBL898553 0.79 HCAR2 (0.53) HCAR2NAAACA12CA1CA2
SCHEMBL27499259 0.77 ATM (0.52) HCAR2NAAACA12CA1CA2
SCHEMBL27496068 0.70 NAAA (0.54) HCAR2NAAACA12CA1CA2
SCHEMBL27514704 0.70 NAAA (0.54) HCAR2NAAACA12CA1CA2
SCHEMBL4678896 0.70 TSHR (0.70) HCAR2NAAAEPHX1TSHRRAD52
SCHEMBL27540314 0.70 NAAA (0.48) HCAR2NAAACA12CA1CA2
SCHEMBL10949093 0.70 HCAR2 (0.50) HCAR2NAAACA12CA1CA2
SCHEMBL5928503 0.70 HCAR2 (0.50) HCAR2NAAACA12CA1CA2

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-1478141-A Hand dishwashing composition containing suds supperesser and method of use therefor 宝洁公司 2004-02-25 CN disclosed
CN-1476309-A Dishwashing wipe and process of cleaning dishware using said wipe 宝洁公司 2004-02-18 CN disclosed