SCHEMBL486916

SCHEMBL486916

CCCCCCCCC(C)C(=O)CC

nearest known ligand 0.63

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.59
ACE2 Q9BYF1 1/20 0.53
FFAR1 O14842 2/20 0.48
FFAR4 Q5NUL3 1/20 0.48
GPR84 Q9NQS5 6/20 0.48
FDPS P14324 3/20 0.48
MAPT P10636 1/20 0.47
LCK P06239 1/20 0.47
PPARD Q03181 1/20 0.47
ZDHHC20 Q5W0Z9 1/20 0.47
ZDHHC2 Q9UIJ5 1/20 0.47

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
SCHEMBL13267645 1.00 CA1 (0.59) CA1ACE2FFAR1FFAR4GPR84
SCHEMBL26106191 1.00 CA1 (0.59) CA1ACE2FFAR1FFAR4GPR84
SCHEMBL8898661 0.98 CA1 (0.61) CA1ACE2FFAR1FFAR4GPR84
SCHEMBL19004774 0.91 CA1 (0.52) CA1ACE2FFAR4FDPS
SCHEMBL3286382 0.91 CA1 (0.52) CA1ACE2FFAR4FDPS
SCHEMBL18092724 0.86 BLM (0.47) CA1ACE2FFAR1FFAR4GPR84
SCHEMBL4255452 0.86 BLM (0.47) CA1ACE2FFAR1FFAR4GPR84
SCHEMBL10904396 0.84 CA1 (0.57) CA1ACE2FFAR1FFAR4
SCHEMBL10904395 0.84 CA1 (0.57) CA1ACE2FFAR1FFAR4
SCHEMBL11115354 0.84 CA1 (0.57) CA1ACE2FFAR1FFAR4

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
EP-1178031-B1 PROCESS FOR THE PREPARATION OF ORGANIC COMPOUNDS WITH MANGANESE CATALYSTS OR THE LIKE DAICEL CHEM (JP) 2012-02-01 EP disclosed
US-6548713-B2 Efficiently producing a compound having an alkyl group or alkenyl group bonded at the alpha position of an electron attractive group, by catalytic radical addition reaction with compound of Group 5,6,7,8, or 9 DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2003-04-15 US disclosed
US-20020165416-A1 Process for the preparation of organic compounds with manganese cataylsts or the like DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2002-11-07 US disclosed
EP-1178031-A1 PROCESS FOR THE PREPARATION OF ORGANIC COMPOUNDS WITH MANGANESE CATALYSTS OR THE LIKE Daicel Chemical Industries, Ltd. (JP) 2002-02-06 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 (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-20020165416-A1 Process for the preparation of organic compounds with manganese cataylsts or the like SOD1, CAT, SOD3 CA1 1250/4885ACE2 3298/4885FFAR1 1536/4885

“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.