SCHEMBL486943

SCHEMBL486943

CCCCCCC(O)CCC(=O)c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 1/20 0.56
FFAR1 O14842 1/20 0.56
L3MBTL1 Q9Y468 2/20 0.53
LMNA P02545 1/20 0.53
MAPT P10636 1/20 0.53
TDP1 Q9NUW8 1/20 0.53
GPR84 Q9NQS5 3/20 0.53
CES2 O00748 2/20 0.51
CES1 P23141 2/20 0.51
HSD17B3 P37058 5/20 0.49
HDAC3 O15379 1/20 0.49
HDAC4 P56524 1/20 0.49
HDAC1 Q13547 1/20 0.49
HDAC7 Q8WUI4 1/20 0.49
HDAC2 Q92769 1/20 0.49
HDAC10 Q969S8 1/20 0.49
HDAC11 Q96DB2 1/20 0.49
HDAC8 Q9BY41 1/20 0.49
HDAC6 Q9UBN7 1/20 0.49
HDAC9 Q9UKV0 1/20 0.49

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
SCHEMBL7858186 0.98 FFAR4 (0.53) FFAR4FFAR1L3MBTL1LMNAMAPT
SCHEMBL7857050 0.94 L3MBTL1 (0.52) FFAR4FFAR1L3MBTL1LMNAMAPT
SCHEMBL27868596 0.86 GPR84 (0.59) FFAR4FFAR1GPR84CES2CES1
SCHEMBL8473581 0.86 GPR84 (0.59) FFAR4FFAR1GPR84CES2CES1
Benzoic Acid SCHEMBL28711585 0.85 FFAR4 (0.56) FFAR4FFAR1GPR84CES2CES1
Benzoic Acid SCHEMBL27846691 0.85 FFAR4 (0.56) FFAR4FFAR1GPR84CES2CES1
Benzoic Acid SCHEMBL10946836 0.85 FFAR4 (0.56) FFAR4FFAR1GPR84CES2CES1
SCHEMBL1706490 0.84 S1PR2 (0.54) L3MBTL1LMNAMAPTTDP1CES2
SCHEMBL29886809 0.84 L3MBTL1 (0.53) L3MBTL1LMNAMAPTTDP1CES2
SCHEMBL8471030 0.84 GPR84 (0.56) FFAR4FFAR1GPR84CES2CES1

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 FFAR4 2708/4885FFAR1 1536/4885L3MBTL1 554/4885

“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.