SCHEMBL5580811

SCHEMBL5580811

COCOc1cccc(-c2cccc(CC(=O)O)c2)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CFD P00746 1/20 0.53
▸ PTPN11 Q06124 2/20 0.48
▸ FFAR1 O14842 3/20 0.47
▸ PPARD Q03181 3/20 0.47
▸ FYN P06241 1/20 0.47
▸ NR4A2 P43354 1/20 0.47
▸ MRGPRX4 Q96LA9 1/20 0.47
▸ GRIN2D O15399 1/20 0.47
▸ GRIN3B O60391 1/20 0.47
▸ GRIN1 Q05586 1/20 0.47
▸ GRIN2A Q12879 1/20 0.47
▸ GRIN2B Q13224 1/20 0.47
▸ GRIN2C Q14957 1/20 0.47
▸ GRIN3A Q8TCU5 1/20 0.47
▸ PLA2G4B P0C869 1/20 0.46
▸ ENPP2 Q13822 1/20 0.46
▸ RXRA P19793 1/20 0.46
▸ RXRB P28702 1/20 0.46
▸ LMNA P02545 1/20 0.44
▸ PTGS2 P35354 1/20 0.44

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
SCHEMBL3901473 0.91 FFAR1 (0.54) FFAR1PPARDMRGPRX4PLA2G4BLMNA
SCHEMBL4214472 0.85 RXRA (0.62) CFDPTPN11FFAR1PPARDNR4A2
SCHEMBL4207967 0.85 PTGS1 (0.59) CFDFFAR1PPARDGRIN2DGRIN3B
SCHEMBL3908596 0.82 CFD (0.66) CFDFFAR1NR4A2MRGPRX4ENPP2
SCHEMBL12826915 0.82 PTPN11 (0.69) CFDPTPN11FFAR1PPARDPLA2G4B
SCHEMBL9422520 0.80 LTA4H (0.49) FYNNR4A2MRGPRX4RXRARXRB
SCHEMBL5580582 0.80 FYN (0.47) CFDFFAR1PPARDFYNNR4A2
SCHEMBL5580585 0.80 FYN (0.47) CFDFFAR1PPARDFYNNR4A2
SCHEMBL4686319 0.79 FFAR1 (0.48) FFAR1MRGPRX4PLA2G4BLMNA
SCHEMBL7789712 0.78 RXRA (0.74) FYNNR4A2MRGPRX4RXRARXRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070105959-A1 Cynnamyl alcohol derivative compounds and drugs containing the compounds as active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2007-05-10 — — US disclosed
EP-1604971-A1 CINNAMYL ALCOHOL DERIVATIVE COMPOUNDS AND DRUGS CONTAINING THE COMPOUNDS AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 2005-12-14 — — 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-20070105959-A1 Cynnamyl alcohol derivative compounds and drugs containing the compounds as active ingredient LPL, GPR119, EBP CFD 2612/4885PTPN11 863/4885FFAR1 134/4885

“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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