SCHEMBL5740376

SCHEMBL5740376

CCCCCC(C(=O)O)C(=O)C(O)CO

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 7/20 0.57
FFAR1 O14842 2/20 0.57
MAPT P10636 1/20 0.46
LCK P06239 1/20 0.46
PPARD Q03181 1/20 0.46
ZDHHC20 Q5W0Z9 1/20 0.46
ZDHHC2 Q9UIJ5 1/20 0.46
OR51E2 Q9H255 1/20 0.43
FFAR4 Q5NUL3 1/20 0.43
ACE2 Q9BYF1 1/20 0.43
LMNA P02545 1/20 0.42
GRIK1 P39086 1/20 0.41
SLC1A2 P43004 1/20 0.41
SLC1A1 P43005 1/20 0.41
GRIK2 Q13002 1/20 0.41
SPHK1 Q9NYA1 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
SCHEMBL168064 0.98 GPR84 (0.60) GPR84FFAR1MAPTLCKPPARD
SCHEMBL1237975 0.98 GPR84 (0.60) GPR84FFAR1MAPTLCKPPARD
SCHEMBL165537 0.98 GPR84 (0.60) GPR84FFAR1MAPTLCKPPARD
SCHEMBL167865 0.98 GPR84 (0.60) GPR84FFAR1MAPTLCKPPARD
SCHEMBL167222 0.98 GPR84 (0.60) GPR84FFAR1MAPTLCKPPARD
SCHEMBL425589 0.98 GPR84 (0.60) GPR84FFAR1MAPTLCKPPARD
SCHEMBL17646227 0.98 GPR84 (0.60) GPR84FFAR1MAPTLCKPPARD
SCHEMBL584656 0.98 GPR84 (0.60) GPR84FFAR1MAPTLCKPPARD
SCHEMBL2858482 0.95 GPR84 (0.56) GPR84FFAR1MAPTLCKPPARD
SCHEMBL5907610 0.94 GPR84 (0.48) GPR84FFAR1MAPTLCKPPARD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120142744-A1 NOVEL COMPLEXES OF FATTY ACID ESTERS OF POLYHYDROXYALKANES AND PYRIDINE CARBOXY DERIVATIVES ASTION DERMATOLOGY A/S 2012-06-07 US disclosed
US-8084049-B2 Complexes of fatty acid esters of polyhydroxyalkanes and pyridine carboxy derivatives ASTION DERMATOLOGY A/S (DK) 2011-12-27 US disclosed
EP-1560589-B1 NOVEL COMPLEXES OF FATTY ACID ESTERS OF POLYHYDROXYALKANES AND NIACINAMIDE ASTION DERMATOLOGY AS (DK) 2006-10-04 EP disclosed
US-20060069131-A1 Novel complexes of fatty acid esters of polyhydroxyalkanes and pyridine carboxy derivatives ASTION DERMATOLOGY A/S 2006-03-30 US disclosed
EP-1640011-A1 Novel complexes of fatty acid esters of polyhydroxylalkanes and pyridine carboxy derivates Astion Dermatology A/S (DK) 2006-03-29 EP disclosed
CN-1674921-A Novel complexes of fatty acid esters of polyhydroxyalkanes and pyridine carboxy derivatives ASTION DERMATOLOGY AS (DK) 2005-09-28 CN 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-20120142744-A1 NOVEL COMPLEXES OF FATTY ACID ESTERS OF POLYHYDROXYALKANES AND PYRIDINE CARBOXY DERIVATIVES FFAR3, FADS1, FASN GPR84 167/4885FFAR1 4/4885MAPT 4755/4885
US-20060069131-A1 Novel complexes of fatty acid esters of polyhydroxyalkanes and pyridine carboxy derivatives FFAR3, FADS1, FASN GPR84 168/4885FFAR1 5/4885MAPT 4739/4885

“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.