SCHEMBL18514949

SCHEMBL18514949

CCC(=O)N(CC)c1ccccc1COc1ccc(CC)cc1C

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ FFAR4 Q5NUL3 10/20 0.47
▸ FFAR1 O14842 5/20 0.47
▸ CD274 Q9NZQ7 8/20 0.45
▸ ALDH1A1 P00352 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39

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
SCHEMBL18515009 0.90 CD274 (0.41) FFAR4FFAR1CD274ALDH1A1HSD17B10
SCHEMBL18749573 0.89 MRGPRX4 (0.44) FFAR4FFAR1CD274ALDH1A1HSD17B10
SCHEMBL18514359 0.88 CD274 (0.48) FFAR4FFAR1CD274
SCHEMBL18515524 0.88 FFAR4 (0.47) FFAR4FFAR1CD274
SCHEMBL18515114 0.86 FFAR4 (0.46) FFAR4FFAR1CD274
SCHEMBL18514935 0.86 SLC22A12 (0.43) FFAR4FFAR1CD274ALDH1A1HSD17B10
SCHEMBL18515084 0.86 FFAR4 (0.46) FFAR4FFAR1CD274
SCHEMBL18514987 0.84 FFAR4 (0.39) FFAR4FFAR1CD274ALDH1A1HSD17B10
SCHEMBL18514951 0.84 FFAR4 (0.43) FFAR4FFAR1CD274ALDH1A1HSD17B10
SCHEMBL18514934 0.84 FFAR4 (0.38) FFAR4FFAR1CD274ALDH1A1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9788547-B2 Aromatic compound and uses thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-10-17 — — US disclosed
US-20170105416-A1 AROMATIC COMPOUND AND USES THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-04-20 — — US disclosed
US-20170105413-A1 AROMATIC COMPOUND AND USES THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-04-20 — — US disclosed
EP-3130584-A1 AROMATIC COMPOUND AND USES THEREOF Sumitomo Chemical Company Limited (JP) 2017-02-15 — — 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-20170105413-A1 AROMATIC COMPOUND AND USES THEREOF TYR, H1-3, H1-0 FFAR4 4194/4885FFAR1 3450/4885CD274 2684/4885
US-20170105416-A1 AROMATIC COMPOUND AND USES THEREOF TYR, H1-3, H1-10 FFAR4 4026/4885FFAR1 3287/4885CD274 2976/4885

“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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