SCHEMBL3673611

SCHEMBL3673611

O=C(O)CCCCOc1cc(C2=NOC3(CCOC3)C2)ccc1OC(F)(F)F

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 8/20 0.37
FFAR1 O14842 4/20 0.37
PTGDR2 Q9Y5Y4 1/20 0.36
CYP2C9 P11712 1/20 0.34
SCN5A Q14524 1/20 0.34
SSTR5 P35346 4/20 0.34
PPARA Q07869 5/20 0.33
PPARD Q03181 3/20 0.33
PPARG P37231 2/20 0.33
WNT3A P56704 1/20 0.33

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
SCHEMBL917854 0.88 PTGDR2 (0.36) FFAR4PTGDR2SSTR5PPARA
SCHEMBL3674939 0.79 PTGDR2 (0.35) PTGDR2SSTR5PPARAPPARD
SCHEMBL3674756 0.76 SSTR5 (0.35) PTGDR2SSTR5
SCHEMBL917561 0.76 PPARA (0.33) CYP2C9SSTR5PPARAPPARG
SCHEMBL4867660 0.76 PDE4B (0.42) SSTR5
SCHEMBL3679579 0.75 SSTR5 (0.34) SSTR5
SCHEMBL917121 0.75 FPR2 (0.34) SSTR5
SCHEMBL3671921 0.75 SSTR5 (0.39) SSTR5
SCHEMBL3549573 0.75 PDE4B (0.39)
SCHEMBL3679430 0.75 SSTR5 (0.39) SSTR5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100004215-A1 COMPOSITIONS OF PHOSPHODIESTERASE TYPE IV INHIBITORS RANBAXY LABORATORIES LIMITED (IN) 2010-01-07 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-20100004215-A1 COMPOSITIONS OF PHOSPHODIESTERASE TYPE IV INHIBITORS PDE4B, PDE4A, PDE3B FFAR4 584/4885FFAR1 877/4885PTGDR2 82/4885

“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.