SCHEMBL6276864

SCHEMBL6276864

CC=COc1c(O)c2c(OCCC(O)CO)cccc2oc1=O

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ NQO1 P15559 2/20 0.39
▸ GPR35 Q9HC97 2/20 0.34
▸ LMNA P02545 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34
▸ MEN1 O00255 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ HIF1A Q16665 1/20 0.33
▸ ALOX15 P16050 1/20 0.33
▸ CYP2A6 P11509 1/20 0.31
▸ ADRB2 P07550 2/20 0.30
▸ NMT2 O60551 1/20 0.30
▸ ADRB1 P08588 1/20 0.30
▸ ADRB3 P13945 1/20 0.30
▸ NMT1 P30419 1/20 0.30

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
SCHEMBL6276860 1.00 NQO1 (0.39) NQO1GPR35LMNATDP1MEN1
SCHEMBL6271675 0.87 NQO1 (0.43) NQO1TDP1MEN1KMT2ACYP2A6
SCHEMBL6271677 0.87 NQO1 (0.43) NQO1TDP1MEN1KMT2ACYP2A6
SCHEMBL6276215 0.86 NQO1 (0.43) NQO1TDP1MEN1KMT2ACYP2A6
SCHEMBL6276208 0.86 NQO1 (0.43) NQO1TDP1MEN1KMT2ACYP2A6
SCHEMBL6270518 0.86 NQO1 (0.48) NQO1GPR35LMNATDP1MEN1
SCHEMBL6276932 0.85 NQO1 (0.42) NQO1GPR35LMNATDP1MEN1
SCHEMBL6273163 0.85 POLM (0.35) NQO1
SCHEMBL6273160 0.85 POLM (0.35) NQO1
SCHEMBL6275919 0.85 CNR2 (0.32) MEN1KMT2A

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 NQO1 1320/4885GPR35 136/4885LMNA 4503/4885

“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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