SCHEMBL2470290

SCHEMBL2470290

C=Cc1ccc(CCOCCOCCOCCCN)cc1

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.37
KCNH2 Q12809 1/20 0.35
HTR2A P28223 2/20 0.33
TAAR1 Q96RJ0 2/20 0.33
HDAC8 Q9BY41 1/20 0.33
MAOA P21397 1/20 0.32
AKT2 P31751 1/20 0.31
CHRNB2 P17787 1/20 0.31
CHRNB4 P30926 1/20 0.31
CHRNA3 P32297 1/20 0.31
CHRNA7 P36544 1/20 0.31
CHRNA4 P43681 1/20 0.31
HRH1 P35367 2/20 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
SCHEMBL3830948 0.88 ALDH1A1 (0.41) ALDH1A1HTR2ATAAR1HDAC8CHRNB2
SCHEMBL2402230 0.86 ALDH1A1 (0.50) ALDH1A1KCNH2HDAC8CHRNB2CHRNB4
SCHEMBL2468564 0.83 ALDH1A1 (0.37) ALDH1A1KCNH2CHRNB2CHRNB4CHRNA3
SCHEMBL9108807 0.83 ALDH1A1 (0.43) ALDH1A1KCNH2CHRNB2CHRNB4CHRNA3
SCHEMBL3827820 0.82 ALDH1A1 (0.42) ALDH1A1KCNH2TAAR1CHRNB2CHRNB4
SCHEMBL5197837 0.82 ALDH1A1 (0.46) ALDH1A1KCNH2HDAC8CHRNB2CHRNB4
SCHEMBL2468949 0.81 ALDH1A1 (0.38) ALDH1A1KCNH2HDAC8CHRNB2CHRNB4
SCHEMBL3474955 0.80 ALDH1A1 (0.44) ALDH1A1KCNH2HDAC8CHRNB2CHRNB4
SCHEMBL5702994 0.80 THRB (0.42) ALDH1A1KCNH2HTR2ACHRNB2CHRNB4
SCHEMBL3626967 0.80 ALDH1A1 (0.48) ALDH1A1HTR2ATAAR1HDAC8MAOA

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1642931-B1 EMULSION COMPOSITION OF MODIFIED POLYPROPYLENE TONEN SEKIYUKAGAKU KK (JP) 2011-10-05 EP disclosed
US-20070004847-A1 Emulsion composition of modified polypropylene TONEN CHEMICAL CORPORATION (JP) 2007-01-04 US disclosed
US-20060281859-A1 Method for producing modified polyolefin solution TONEN CHEMICAL CORPORATION (JP) 2006-12-14 US disclosed
EP-1642931-A1 EMULSION COMPOSITION OF MODIFIED POLYPROPYLENE Tonen Chemical Corporation (JP) 2006-04-05 EP disclosed
EP-1607415-A1 METHOD FOR PRODUCING MODIFIED POLYOLEFIN SOLUTION Tonen Chemical Corporation (JP) 2005-12-21 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070004847-A1 Emulsion composition of modified polypropylene POLD1, DDHD2, POP1 ALDH1A1 3661/4885KCNH2 4673/4885HTR2A 1709/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.