SCHEMBL4134068

SCHEMBL4134068

CN(CCCCCCc1cccc(OCCCC(=O)O)c1CCC(=O)O)c1cc(-c2ccccc2F)cc(-c2ccccc2F)c1

nearest known ligand 0.62

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
LTB4R Q15722 19/20 0.62
CYP2C9 P11712 2/20 0.62
LTB4R2 Q9NPC1 7/20 0.58
FFAR4 Q5NUL3 1/20 0.49

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
SCHEMBL1689715 0.89 LTB4R (0.72) LTB4RCYP2C9LTB4R2
SCHEMBL1689817 0.89 LTB4R (0.73) LTB4RCYP2C9LTB4R2
SCHEMBL1689754 0.87 LTB4R (0.68) LTB4RCYP2C9LTB4R2
SCHEMBL1689861 0.84 LTB4R (0.73) LTB4RCYP2C9LTB4R2
SCHEMBL10165202 0.84 LTB4R (0.65) LTB4RCYP2C9LTB4R2
SCHEMBL10165108 0.84 LTB4R (0.59) LTB4RCYP2C9LTB4R2
Ammonia Solution, Strong SCHEMBL1689719 0.83 LTB4R (0.64) LTB4RCYP2C9LTB4R2
SCHEMBL1690010 0.83 LTB4R (0.84) LTB4RCYP2C9LTB4R2
SCHEMBL1689850 0.83 LTB4R (0.75) LTB4RCYP2C9LTB4R2
SCHEMBL1689983 0.83 LTB4R (0.58) LTB4RCYP2C9LTB4R2

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
US-8093385-B2 Leukotriene B4 inhibitors HOFFMANN-LA ROCHE INC. (US) 2012-01-10 US disclosed
US-8093385-B2 Leukotriene B4 inhibitors HOFFMANN-LA ROCHE INC. (US) 2012-01-10 US disclosed
US-20090054466-A1 Leukotriene B4 Inhibitors DOMINIQUE ROMYR 2009-02-26 US disclosed
US-20090054466-A1 Leukotriene B4 Inhibitors DOMINIQUE ROMYR 2009-02-26 US disclosed
US-20090054466-A1 Leukotriene B4 Inhibitors DOMINIQUE ROMYR 2009-02-26 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 (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-20090054466-A1 Leukotriene B4 Inhibitors LTB4R2, LTB4R, LTC4S LTB4R 2/4885CYP2C9 279/4885LTB4R2 1/4885

“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.