SCHEMBL18514950

SCHEMBL18514950

CCC(=O)N(CC)c1cccc(Cl)c1COc1ccc(CC)cc1C

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ FFAR4 Q5NUL3 6/20 0.43
▸ FFAR1 O14842 4/20 0.43
▸ LTB4R Q15722 1/20 0.39
▸ LTB4R2 Q9NPC1 1/20 0.39
▸ MRGPRX4 Q96LA9 3/20 0.39
▸ PPARA Q07869 1/20 0.38
▸ MEN1 O00255 2/20 0.37
▸ KMT2A Q03164 2/20 0.37
▸ ALDH1A1 P00352 2/20 0.37
▸ HPGD P15428 1/20 0.37
▸ NPSR1 Q6W5P4 1/20 0.37
▸ NR1H4 Q96RI1 1/20 0.37
▸ HSD17B10 Q99714 1/20 0.36
▸ CD274 Q9NZQ7 1/20 0.36
▸ SLC22A12 Q96S37 1/20 0.36

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
SCHEMBL18514935 0.90 SLC22A12 (0.43) FFAR4FFAR1MRGPRX4PPARAMEN1
SCHEMBL18749327 0.89 MRGPRX4 (0.44) FFAR4FFAR1LTB4RLTB4R2MRGPRX4
SCHEMBL18515009 0.89 CD274 (0.41) FFAR4FFAR1MRGPRX4ALDH1A1HSD17B10
SCHEMBL18514987 0.88 FFAR4 (0.39) FFAR4FFAR1MRGPRX4PPARAALDH1A1
SCHEMBL18514361 0.88 FFAR4 (0.44) FFAR4FFAR1MRGPRX4PPARANR1H4
SCHEMBL18515520 0.88 FFAR4 (0.44) FFAR4FFAR1LTB4RLTB4R2MRGPRX4
SCHEMBL18515117 0.88 FFAR4 (0.42) FFAR4FFAR1LTB4RLTB4R2MRGPRX4
SCHEMBL18515186 0.88 FFAR4 (0.42) FFAR4FFAR1LTB4RLTB4R2MRGPRX4
SCHEMBL18514952 0.88 ALDH1A1 (0.44) FFAR4FFAR1MRGPRX4PPARAMEN1
SCHEMBL18514951 0.88 FFAR4 (0.43) FFAR4FFAR1MRGPRX4PPARAALDH1A1

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 3450/4885LTB4R 4616/4885
US-20170105416-A1 AROMATIC COMPOUND AND USES THEREOF TYR, H1-3, H1-10 FFAR4 4026/4885FFAR1 3287/4885LTB4R 3746/4885

“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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