SCHEMBL6276941

SCHEMBL6276941

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

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 4/20 0.38
PTGIR P43119 11/20 0.37
TBXA2R P21731 10/20 0.37
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
HPGD P15428 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
GLA P06280 1/20 0.36
L3MBTL1 Q9Y468 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
SCHEMBL6276278 0.97 CNR2 (0.38) CNR2PTGIRTBXA2RKDM4EALDH1A1
SCHEMBL6276906 0.94 PTGIR (0.39) CNR2PTGIRTBXA2RKDM4EALDH1A1
SCHEMBL6276743 0.87 CNR2 (0.41) CNR2
SCHEMBL6275403 0.86 CNR2 (0.40) CNR2KDM4EALDH1A1
SCHEMBL6273134 0.85 NQO1 (0.38) KDM4EALDH1A1HPGDGLAL3MBTL1
SCHEMBL6277696 0.85 ALDH1A1 (0.40) PTGIRTBXA2RKDM4EALDH1A1HPGD
SCHEMBL6277228 0.84 CNR2 (0.45) CNR2PTGIRTBXA2RKDM4EALDH1A1
SCHEMBL6276067 0.84 CNR2 (0.40) CNR2
SCHEMBL6271658 0.83 CNR2 (0.42) CNR2PTGIRTBXA2RKDM4EALDH1A1
SCHEMBL6277151 0.83 ALDH1A1 (0.43) 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 CNR2 249/4885PTGIR 316/4885TBXA2R 333/4885

“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.