SCHEMBL6276906

SCHEMBL6276906

CCCC(CC)Oc1c(O)c2cccc(OCC(=O)O)c2oc1=O

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PTGIR P43119 13/20 0.39
TBXA2R P21731 12/20 0.39
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
HPGD P15428 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
GLA P06280 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
NQO1 P15559 1/20 0.37
ADORA3 P0DMS8 1/20 0.36
ADORA2A P29274 1/20 0.36
ADORA1 P30542 1/20 0.36
FHIT P49789 1/20 0.36
CNR2 P34972 1/20 0.36

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
SCHEMBL6276941 0.94 CNR2 (0.38) PTGIRTBXA2RKDM4EALDH1A1HPGD
SCHEMBL6276278 0.93 CNR2 (0.38) PTGIRTBXA2RKDM4EALDH1A1HPGD
SCHEMBL6277737 0.87 CNR2 (0.39) KDM4EALDH1A1HPGDNQO1ADORA3
SCHEMBL6277696 0.86 ALDH1A1 (0.40) PTGIRTBXA2RKDM4EALDH1A1HPGD
SCHEMBL6277151 0.85 ALDH1A1 (0.43) PTGIRTBXA2RKDM4EALDH1A1HPGD
SCHEMBL6274677 0.84 NQO1 (0.40) KDM4EALDH1A1HPGDTDP1GLA
SCHEMBL6274662 0.84 PTGIR (0.39) PTGIRTBXA2RKDM4EALDH1A1HPGD
SCHEMBL6270539 0.83 ALDH1A1 (0.43) PTGIRTBXA2RKDM4EALDH1A1HPGD
SCHEMBL6272596 0.82 GLA (0.50) PTGIRTBXA2RKDM4EALDH1A1HPGD
SCHEMBL6277228 0.82 CNR2 (0.45) PTGIRTBXA2RKDM4EALDH1A1HPGD

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 PTGIR 316/4885TBXA2R 333/4885KDM4E 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.