SCHEMBL6700517

SCHEMBL6700517

CN(C(=O)CCc1ccccc1)C1CCC(c2ccc(OCc3ccccc3)cn2)CC1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 4/20 0.44
FFAR4 Q5NUL3 2/20 0.44
CCR5 P51681 1/20 0.44
P4HTM Q9NXG6 1/20 0.44
LTB4R Q15722 2/20 0.43
LTB4R2 Q9NPC1 2/20 0.43
CYP4F2 P78329 2/20 0.43
CYP4A11 Q02928 2/20 0.43
ALOX5 P09917 1/20 0.42
L3MBTL1 Q9Y468 2/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
SIGMAR1 Q99720 1/20 0.41
ACACB O00763 2/20 0.41
ACACA Q13085 2/20 0.41
EGFR P00533 1/20 0.40

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
SCHEMBL6700513 1.00 FFAR1 (0.44) FFAR1FFAR4CCR5P4HTMLTB4R
SCHEMBL6266490 0.87 ME2 (0.44) FFAR4CCR5L3MBTL1MEN1KMT2A
SCHEMBL8331834 0.87 ME2 (0.44) FFAR4CCR5L3MBTL1MEN1KMT2A
SCHEMBL6266483 0.87 ME2 (0.44) FFAR4CCR5L3MBTL1MEN1KMT2A
Hydrochloric Acid SCHEMBL5961253 0.86 ME2 (0.43) FFAR4L3MBTL1MEN1KMT2ASIGMAR1
Hydrochloric Acid SCHEMBL6699035 0.86 ME2 (0.43) FFAR4L3MBTL1MEN1KMT2ASIGMAR1
SCHEMBL6694929 0.84 CCR5 (0.43) FFAR1FFAR4CCR5P4HTMLTB4R
SCHEMBL6694926 0.84 CCR5 (0.43) FFAR1FFAR4CCR5P4HTMLTB4R
SCHEMBL6694922 0.84 CCR5 (0.43) FFAR1FFAR4CCR5P4HTMLTB4R
SCHEMBL20754970 0.80 L3MBTL1 (0.54) P4HTMALOX5L3MBTL1MEN1KMT2A

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-20040152715-A1 Cycloalkylene amide compounds as NR2B receptor antagonists KAWAI MAKOTO (JP) 2004-08-05 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-20040152715-A1 Cycloalkylene amide compounds as NR2B receptor antagonists GRIN1, GRIN3A, GRIN2A FFAR1 135/4885FFAR4 249/4885CCR5 573/4885

“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.