SCHEMBL6272791

SCHEMBL6272791

CC(C)=CCCC(C)=CCOc1c(O)c2ccc(O)cc2oc1=O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 5/20 0.58
▸ CYP3A4 P08684 4/20 0.58
▸ BACE1 P56817 4/20 0.58
▸ KDM4E B2RXH2 3/20 0.58
▸ ALDH1A1 P00352 3/20 0.58
▸ HPGD P15428 3/20 0.58
▸ MAPT P10636 2/20 0.58
▸ MAPK1 P28482 2/20 0.58
▸ HSD17B10 Q99714 2/20 0.58
▸ CYP2E1 P05181 1/20 0.58
▸ CYP2D6 P10635 1/20 0.58
▸ CYP2C9 P11712 1/20 0.58
▸ TSHR P16473 1/20 0.58
▸ CYP2B6 P20813 1/20 0.58
▸ CYP3A5 P20815 1/20 0.58
▸ CYP2C19 P33261 1/20 0.58
▸ MEN1 O00255 1/20 0.58
▸ KMT2A Q03164 1/20 0.58
▸ MGAM O43451 2/20 0.53
▸ GAA P10253 2/20 0.53

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
SCHEMBL6272788 1.00 TDP1 (0.58) TDP1CYP3A4BACE1KDM4EALDH1A1
SCHEMBL8496688 0.92 TDP1 (0.61) TDP1CYP3A4BACE1KDM4EALDH1A1
SCHEMBL8496149 0.91 TDP1 (0.60) TDP1CYP3A4BACE1KDM4EALDH1A1
SCHEMBL6274230 0.91 MGAM (0.60) TDP1CYP3A4BACE1KDM4EALDH1A1
SCHEMBL6274227 0.91 MGAM (0.60) TDP1CYP3A4BACE1KDM4EALDH1A1
SCHEMBL8490417 0.90 ALOX15 (0.62) TDP1CYP3A4BACE1KDM4EALDH1A1
SCHEMBL8489726 0.90 ALDH1A1 (0.52) TDP1CYP3A4KDM4EALDH1A1HPGD
SCHEMBL8492442 0.89 TDP1 (0.58) TDP1CYP3A4BACE1KDM4EALDH1A1
SCHEMBL8492448 0.89 TDP1 (0.58) TDP1CYP3A4BACE1KDM4EALDH1A1
SCHEMBL8490205 0.89 TDP1 (0.58) TDP1CYP3A4BACE1KDM4EALDH1A1

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 6 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
US-5981495-A TREATING HEART DISEASE BY ADMINISTERING TO THE HEART PATIENT A BENOPYRAN DERIVATIVE DAINIPPON INK AND CHEMICALS, INC. (JP) 1999-11-09 — — US disclosed
EP-0796854-A1 Benzopyran derivative and use of said benzopyran derivative for treating heart disease DAINIPPON INK AND CHEMICALS, INC. (JP) 1997-09-24 — — 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 TDP1 2417/4885CYP3A4 14/4885BACE1 3338/4885

“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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