SCHEMBL5516567

SCHEMBL5516567

C=CC(COc1ccccc1)OC(C)=O

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.51
MTNR1A P48039 4/20 0.50
MTNR1B P49286 4/20 0.50
MAPT P10636 3/20 0.46
POLB P06746 2/20 0.46
THRB P10828 2/20 0.44
CYP2D6 P10635 2/20 0.43
ADRB2 P07550 1/20 0.43
ADRB1 P08588 1/20 0.43
ADRB3 P13945 1/20 0.43
NPSR1 Q6W5P4 1/20 0.42
ALOX15 P16050 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL9461691 0.86 LMNA (0.47) LMNAMTNR1AMTNR1BMAPTPOLB
SCHEMBL2074009 0.80 ALDH1A1 (0.47) MAPTNPSR1ALOX15
SCHEMBL9130845 0.80 MTNR1A (0.53) LMNAMTNR1AMTNR1BMAPTPOLB
SCHEMBL3364884 0.80 POLB (0.60) LMNAMTNR1AMTNR1BMAPTPOLB
SCHEMBL5523158 0.79 ALDH1A1 (0.42) LMNAMTNR1AMTNR1BMAPTTHRB
SCHEMBL8376755 0.79 ALDH1A1 (0.44) LMNAMTNR1AMTNR1BPOLB
SCHEMBL9655456 0.79 THRB (0.47) LMNAMTNR1AMTNR1BMAPTPOLB
SCHEMBL578331 0.78 MTNR1A (0.58) LMNAMTNR1AMTNR1BMAPTPOLB
SCHEMBL11306391 0.77 THRB (0.55) LMNAMTNR1AMTNR1BMAPTPOLB
SCHEMBL7242378 0.77 PPARG (0.56) LMNAMTNR1AMTNR1BMAPTPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7241857-B2 Method for producing allyl compound, and ether or ester compound produced thereby MITSUBISHI CHEMICAL CORPORATION (JP) 2007-07-10 US disclosed
US-7173157-B2 Method for producing an allyl compound MITSUBISHI CHEMICAL CORPORATION (JP) 2007-02-06 US disclosed
US-7119222-B2 Method for producing allyl compound, and ether or ester compound produced thereby MITSUBISHI CHEMICAL CORPORATION (JP) 2006-10-10 US disclosed
US-20060106181-A1 Method for producing allyl compound, and ether or ester compound produced thereby MITSUBISHI CHEMICAL CORPORATION (JP) 2006-05-18 US disclosed
US-20050075518-A1 Method for producing allyl compound, and allyl compound produced thereby MITSUBISHI CHEMICAL CORPORATION (JP) 2005-04-07 US disclosed
US-20040147757-A1 Method for producing allyl compound, and ether or ester compound produced thereby MITSUBISHI CHEMICAL CORPORATION (JP) 2004-07-29 US 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 (3 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-20060106181-A1 Method for producing allyl compound, and ether or ester compound produced thereby AGPAT5, TST, AGPAT2 LMNA 4141/4885MTNR1A 4415/4885MTNR1B 4476/4885
US-20040147757-A1 Method for producing allyl compound, and ether or ester compound produced thereby AGPAT5, TST, AGPAT2 LMNA 4141/4885MTNR1A 4415/4885MTNR1B 4476/4885
US-20050075518-A1 Method for producing allyl compound, and allyl compound produced thereby CCNT1, AOC3, ATL3 LMNA 3467/4885MTNR1A 2241/4885MTNR1B 2999/4885

“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.