SCHEMBL6276928

SCHEMBL6276928

CCC=COc1c(O)c2cccc(OCC(=O)O)c2oc1=O

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.40
HPGD P15428 2/20 0.40
KDM4E B2RXH2 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
TBXA2R P21731 11/20 0.39
PTGIR P43119 10/20 0.39
GLA P06280 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
ADORA3 P0DMS8 1/20 0.38
ADORA2A P29274 1/20 0.38
ADORA1 P30542 1/20 0.38
FHIT P49789 1/20 0.38
MIF P14174 1/20 0.36
MAOA P21397 1/20 0.36
MAOB P27338 1/20 0.36
POLB P06746 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
MAPT P10636 1/20 0.35
PKM P14618 1/20 0.35

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
SCHEMBL6276927 1.00 ALDH1A1 (0.40) ALDH1A1HPGDKDM4ETDP1TBXA2R
SCHEMBL6277144 0.90 PPARA (0.38) ALDH1A1HPGDKDM4ETDP1TBXA2R
SCHEMBL6277137 0.90 PPARA (0.38) ALDH1A1HPGDKDM4ETDP1TBXA2R
SCHEMBL6276229 0.89 ALDH1A1 (0.41) ALDH1A1HPGDKDM4ETDP1TBXA2R
SCHEMBL6276234 0.89 ALDH1A1 (0.41) ALDH1A1HPGDKDM4ETDP1TBXA2R
SCHEMBL6274509 0.89 PPARA (0.41) ALDH1A1HPGDKDM4ETDP1TBXA2R
SCHEMBL6274733 0.89 PPARA (0.41) ALDH1A1HPGDKDM4ETDP1TBXA2R
SCHEMBL6274736 0.89 PPARA (0.41) ALDH1A1HPGDKDM4ETDP1TBXA2R
SCHEMBL6274505 0.89 PPARA (0.41) ALDH1A1HPGDKDM4ETDP1TBXA2R
SCHEMBL6276249 0.89 CNR2 (0.37) ALDH1A1SMN1; SMN2

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-1273578-B1 Benzopyran derivatives and antiallergic agent containing the same DAINIPPON INK & CHEMICALS (JP) 2005-02-23 EP disclosed
US-6670391-B2 For inhibiting both immediate and delayed type allergic reactions; side effect reduction DAINIPPON INK AND CHEMICALS, INC. (JP) 2003-12-30 US disclosed
US-20030096860-A1 Benzopyran derivative and antiallergic agent DAINIPPON INK AND CHEMICALS, INC. (JP) 2003-05-22 US disclosed
EP-1273578-A1 Benzopyran derivatives and antiallergic agent containing the same DAINIPPON INK AND CHEMICALS, INC. (JP) 2003-01-08 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-20030096860-A1 Benzopyran derivative and antiallergic agent HRH2, HRH1, HRH4 ALDH1A1 105/4885HPGD 324/4885KDM4E 965/4885

“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.