SCHEMBL6277750

SCHEMBL6277750

CCCCCCOc1c(O)c2ccc(OCCCCO)cc2oc1=O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH2 P05091 4/20 0.51
▸ MAOA P21397 1/20 0.50
▸ MAOB P27338 1/20 0.50
▸ MAP1LC3B Q9GZQ8 1/20 0.48
▸ MAP1LC3A Q9H492 1/20 0.48
▸ KDM4E B2RXH2 3/20 0.47
▸ ALDH1A1 P00352 3/20 0.47
▸ HPGD P15428 3/20 0.47
▸ TSHR P16473 2/20 0.47
▸ HSD17B10 Q99714 2/20 0.47
▸ RAB9A P51151 2/20 0.47
▸ SMN1; SMN2 Q16637 2/20 0.47
▸ MAPT P10636 1/20 0.46
▸ MAPK1 P28482 1/20 0.46
▸ ALPL P05186 1/20 0.46
▸ ALPI P09923 1/20 0.46
▸ NPC1 O15118 1/20 0.46
▸ STS P08842 1/20 0.45
▸ NQO1 P15559 1/20 0.44
▸ CA12 O43570 1/20 0.44

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
SCHEMBL6273118 1.00 ALDH2 (0.51) ALDH2MAOAMAOBMAP1LC3BMAP1LC3A
SCHEMBL6270736 0.98 ALDH2 (0.51) ALDH2MAOAMAOBMAP1LC3BMAP1LC3A
SCHEMBL6271588 0.98 ALDH2 (0.51) ALDH2MAOAMAOBMAP1LC3BMAP1LC3A
SCHEMBL6276289 0.98 ALDH2 (0.51) ALDH2MAOAMAOBMAP1LC3BMAP1LC3A
SCHEMBL6273066 0.98 MAP1LC3B (0.50) ALDH2MAOAMAOBMAP1LC3BMAP1LC3A
SCHEMBL6276949 0.95 ALDH2 (0.53) ALDH2MAOAMAOBMAP1LC3BMAP1LC3A
SCHEMBL6275210 0.95 ALDH2 (0.53) ALDH2MAOAMAOBMAP1LC3BMAP1LC3A
SCHEMBL6275616 0.95 ALDH2 (0.53) ALDH2MAOAMAOBMAP1LC3BMAP1LC3A
SCHEMBL6276950 0.95 ALDH2 (0.53) ALDH2MAOAMAOBMAP1LC3BMAP1LC3A
SCHEMBL8486987 0.95 MAOA (0.54) ALDH2MAOAMAOBMAP1LC3BMAP1LC3A

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 10 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
CN-1473565-A Benzopyrany/derivatives and antiallergic agent ���ձ���ī��ѧ��ʽ���� 2004-02-11 — — CN 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
CN-1101678-C Benzopyran derivative and therapeutic agent for heart disease containing the same as active ingredient DAINIPPON INK & CHEMICALS (JP) 2003-02-19 — — CN disclosed
EP-1273578-A1 Benzopyran derivatives and antiallergic agent containing the same DAINIPPON INK AND CHEMICALS, INC. (JP) 2003-01-08 — — EP disclosed
EP-0796854-B1 Benzopyran derivative and use of said benzopyran derivative for treating heart disease DAINIPPON INK & CHEMICALS (JP) 2002-07-03 — — 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
CN-1164999-A Benzopyran derivative and therapeutic agent for heart disease containing the same as active ingredient DAINIPPON INK & CHEMICALS (JP) 1997-11-19 — — CN 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 ALDH2 590/4885MAOA 665/4885MAOB 1155/4885

“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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