SCHEMBL6270616

SCHEMBL6270616

CC=COc1c(O)c2cccc(OCCCO)c2oc1=O

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 8/20 0.36
LOXL2 Q9Y4K0 1/20 0.34
ANTXR2 P58335 1/20 0.33
MAOA P21397 1/20 0.33
CNR1 P21554 1/20 0.33
TBXA2R P21731 1/20 0.32
PTGIR P43119 1/20 0.32
ADORA3 P0DMS8 3/20 0.32
ADORA2A P29274 2/20 0.32
ADORA1 P30542 2/20 0.32
ESR1 P03372 1/20 0.31
ESR2 Q92731 1/20 0.31

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
SCHEMBL6270615 1.00 CNR2 (0.36) CNR2LOXL2ANTXR2MAOACNR1
SCHEMBL6274499 0.94 ADORA3 (0.35) CNR2LOXL2ANTXR2MAOAADORA3
SCHEMBL6274496 0.94 ADORA3 (0.35) CNR2LOXL2ANTXR2MAOAADORA3
SCHEMBL6275619 0.87 LMNA (0.40) CNR2LOXL2ANTXR2MAOAADORA3
SCHEMBL6275624 0.87 LMNA (0.40) CNR2LOXL2ANTXR2MAOAADORA3
SCHEMBL6275923 0.86 CNR2 (0.32) CNR2ANTXR2MAOAADORA3ADORA2A
SCHEMBL6275919 0.86 CNR2 (0.32) CNR2ANTXR2MAOAADORA3ADORA2A
SCHEMBL6277166 0.86 CNR2 (0.36) CNR2LOXL2ANTXR2MAOACNR1
SCHEMBL6277161 0.86 CNR2 (0.36) CNR2LOXL2ANTXR2MAOACNR1
SCHEMBL6270724 0.85 MAOA (0.43) CNR2LOXL2ANTXR2MAOAADORA3

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 249/4885LOXL2 2470/4885ANTXR2 2741/4885

“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.