SCHEMBL17413767

SCHEMBL17413767

O=C(O)CCc1cccc(OCCCCOc2ccccc2)c1

nearest known ligand 0.71

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ FFAR1 O14842 14/20 0.71
▸ FFAR4 Q5NUL3 4/20 0.60
▸ AKR1B1 P15121 1/20 0.55
▸ KEAP1 Q14145 1/20 0.55
▸ PPARD Q03181 1/20 0.54
▸ CYSLTR2 Q9NS75 1/20 0.54
▸ CYSLTR1 Q9Y271 1/20 0.54
▸ S1PR1 P21453 1/20 0.53

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
SCHEMBL17413763 0.98 FFAR1 (0.69) FFAR1FFAR4AKR1B1PPARDCYSLTR2
SCHEMBL25175611 0.94 FFAR1 (0.76) FFAR1FFAR4KEAP1CYSLTR2CYSLTR1
SCHEMBL17345292 0.88 PPARA (0.69) FFAR1CYSLTR2CYSLTR1
SCHEMBL25456542 0.88 PPARA (0.69) FFAR1CYSLTR2CYSLTR1
SCHEMBL1206101 0.88 PPARA (0.64) FFAR1
SCHEMBL947863 0.88 FFAR1 (0.67) FFAR1CYSLTR2CYSLTR1S1PR1
SCHEMBL1206748 0.86 LMNA (0.68) FFAR1FFAR4PPARD
SCHEMBL2772855 0.86 FFAR1 (0.83) FFAR1FFAR4AKR1B1
SCHEMBL4530820 0.85 FFAR1 (0.88) FFAR1FFAR4PPARDS1PR1
SCHEMBL1746650 0.85 FFAR1 (0.88) FFAR1FFAR4AKR1B1

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-9856278-B2 Lysophosphatidylserine derivative THE UNIVERSITY OF TOKYO (JP) 2018-01-02 — — US disclosed
US-9856278-B2 Lysophosphatidylserine derivative THE UNIVERSITY OF TOKYO (JP) 2018-01-02 — — US disclosed
US-20170210767-A1 LYSOPHOSPHATIDYLSERINE DERIVATIVE THE UNIVERSITY OF TOKYO (JP) 2017-07-27 — — US disclosed
US-20170210767-A1 LYSOPHOSPHATIDYLSERINE DERIVATIVE THE UNIVERSITY OF TOKYO (JP) 2017-07-27 — — US disclosed
US-20170210767-A1 LYSOPHOSPHATIDYLSERINE DERIVATIVE THE UNIVERSITY OF TOKYO (JP) 2017-07-27 — — US disclosed
WO-2016002948-A1 LYSOPHOSPHATIDYLSERINE DERIVATIVE 国立大学法人東京大学 2016-01-07 — — WO 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-20170210767-A1 LYSOPHOSPHATIDYLSERINE DERIVATIVE LPAR3, LPAR1, LPAR4 FFAR1 84/4885FFAR4 80/4885AKR1B1 2441/4885

“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.

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