SCHEMBL6270800

SCHEMBL6270800

CCCOc1c(O)c2c(OCCO)cccc2oc1=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP2A6 P11509 1/20 0.47
▸ CREB1 P16220 1/20 0.46
▸ NQO1 P15559 1/20 0.46
▸ ADORA3 P0DMS8 1/20 0.43
▸ ACE2 Q9BYF1 1/20 0.43
▸ ABCB1 P08183 1/20 0.41
▸ ATM Q13315 1/20 0.39
▸ KDM4E B2RXH2 3/20 0.37
▸ MEN1 O00255 2/20 0.37
▸ KMT2A Q03164 2/20 0.37
▸ ALOX5 P09917 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ PABPC1 P11940 1/20 0.37
▸ TDP1 Q9NUW8 1/20 0.37
▸ POLH Q9Y253 1/20 0.37
▸ ALDH1A1 P00352 2/20 0.36
▸ HPGD P15428 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ PLA2G1B P04054 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
SCHEMBL6274460 0.94 NQO1 (0.45) CYP2A6CREB1NQO1ALOX5POLH
SCHEMBL6276186 0.93 ALOX5 (0.45) NQO1ALOX5
SCHEMBL6274759 0.92 ALOX5 (0.46) NQO1ALOX5
SCHEMBL6276880 0.92 ALOX5 (0.46) NQO1ALOX5
SCHEMBL6274014 0.92 ALOX5 (0.46) NQO1ALOX5
SCHEMBL6274226 0.92 ALOX5 (0.46) NQO1ALOX5
SCHEMBL6274319 0.91 NQO1 (0.47) CYP2A6CREB1NQO1ADORA3ACE2
SCHEMBL6274555 0.89 NQO1 (0.45) CYP2A6CREB1NQO1ALOX5POLH
SCHEMBL6272553 0.88 NQO1 (0.44) CYP2A6NQO1ALOX5ALDH1A1TSHR
SCHEMBL6275142 0.87 NQO1 (0.54) NQO1ABCB1KDM4EMEN1KMT2A

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 CYP2A6 117/4885CREB1 3252/4885NQO1 1320/4885

“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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