SCHEMBL3919111

SCHEMBL3919111

[CH2]CCCCCCC(O)CCCCCCCCCC

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 2/20 0.55
FFAR4 Q5NUL3 1/20 0.55
GPR84 Q9NQS5 8/20 0.52
NFKB1 P19838 1/20 0.48
FDPS P14324 3/20 0.45
SPHK1 Q9NYA1 1/20 0.45
FAAH O00519 1/20 0.44
LMNA P02545 1/20 0.44
PSMD14 O00487 2/20 0.44
PLA2G1B P04054 2/20 0.44
MMP2 P08253 2/20 0.44
ATG4B Q9Y4P1 2/20 0.44
HSP90AA1 P07900 1/20 0.44
RAD52 P43351 1/20 0.44

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
SCHEMBL3922825 1.00 FFAR1 (0.55) FFAR1FFAR4GPR84NFKB1FDPS
SCHEMBL1235231 1.00 FFAR1 (0.55) FFAR1FFAR4GPR84NFKB1FDPS
SCHEMBL3921506 1.00 FFAR1 (0.55) FFAR1FFAR4GPR84NFKB1FDPS
SCHEMBL10382688 1.00 FFAR1 (0.55) FFAR1FFAR4GPR84NFKB1FDPS
SCHEMBL16431765 1.00 FFAR1 (0.55) FFAR1FFAR4GPR84NFKB1FDPS
SCHEMBL1543475 1.00 FFAR1 (0.55) FFAR1FFAR4GPR84NFKB1FDPS
SCHEMBL9008316 1.00 FFAR1 (0.55) FFAR1FFAR4GPR84NFKB1FDPS
SCHEMBL593055 1.00 FFAR1 (0.55) FFAR1FFAR4GPR84NFKB1FDPS
SCHEMBL22400862 1.00 FFAR1 (0.55) FFAR1FFAR4GPR84NFKB1FDPS
SCHEMBL28619360 1.00 FFAR1 (0.55) FFAR1FFAR4GPR84NFKB1FDPS

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-20090306382-A1 CATIONIC ALKOXYAMINES MUEHLEBACH ANDREAS 2009-12-10 US disclosed
US-20020115855-A1 Process for the preparation of 3-aryl-benzofuran-2-ones CIBA SPECIALTY CHEMICALS CORP. 2002-08-22 US disclosed
EP-0143385-B1 PHOSPHORYLISED GLYCOSIL AMIDES, UREAS, CARBAMATES AND THIOCARBAMATES, METHOD FOR THEIR PREPARATION AND THEIR USE BAYER AG (DE) 1989-03-15 EP disclosed
US-4686208-A Phosphorylated glycosyl-amides, -ureas, -carbamates and -thiocarbamates and method of use BAYER AKTIENGESELLSCHAFT (DE) 1987-08-11 US disclosed
EP-0143385-A2 Phosphorylised glycosil amides, ureas, carbamates and thiocarbamates, method for their preparation and their use BAYER AG (DE) 1985-06-05 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 (2 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-20020115855-A1 Process for the preparation of 3-aryl-benzofuran-2-ones CYP1B1, CYP1A1, SULT1A1 FFAR1 2974/4885FFAR4 3477/4885GPR84 4005/4885
US-20090306382-A1 CATIONIC ALKOXYAMINES ALKBH2, ALKBH3, ALKBH5 FFAR1 1138/4885FFAR4 1213/4885GPR84 1738/4885

“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.