SCHEMBL4551367

SCHEMBL4551367

O=C(O)c1cc2ccc(O)c(O)c2[nH]c1=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 1/20 0.46
▸ GAA P10253 3/20 0.46
▸ KDM4E B2RXH2 3/20 0.46
▸ HPGD P15428 2/20 0.46
▸ HSD17B10 Q99714 2/20 0.46
▸ SELL P14151 1/20 0.44
▸ SELP P16109 1/20 0.44
▸ ALDH1A1 P00352 2/20 0.43
▸ POLB P06746 1/20 0.43
▸ LCK P06239 1/20 0.43
▸ DAO P14920 2/20 0.41
▸ DDO Q99489 1/20 0.41
▸ RNASEH1 O60930 1/20 0.41
▸ PTPN11 Q06124 1/20 0.41
▸ GPR35 Q9HC97 1/20 0.41
▸ ATG4B Q9Y4P1 1/20 0.41
▸ MPL P40238 2/20 0.40
▸ PKM P14618 1/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ PDE4A P27815 1/20 0.40

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
SCHEMBL4406397 0.80 CNR2 (0.62) CNR2GAAKDM4EHPGDHSD17B10
SCHEMBL16428858 0.77 HPGD (0.57) KDM4EHPGDHSD17B10ALDH1A1DAO
SCHEMBL31423247 0.77 CNR2 (0.40) CNR2GAAKDM4EHPGDHSD17B10
SCHEMBL29415464 0.76 DHODH (0.58) CNR2GAAKDM4EHPGDHSD17B10
SCHEMBL2808417 0.76 DHODH (0.58) CNR2GAAKDM4EHPGDHSD17B10
SCHEMBL27348185 0.75 DAO (0.64) CNR2GAAKDM4EHPGDHSD17B10
SCHEMBL27443353 0.72 DAO (0.64) CNR2GAAKDM4EHSD17B10ALDH1A1
SCHEMBL9264392 0.72 DAO (0.64) GAAKDM4EHPGDHSD17B10ALDH1A1
SCHEMBL31423163 0.72 NOTUM (0.43) CNR2GAAKDM4EHPGDHSD17B10
SCHEMBL4551849 0.71 CNR2 (0.73) CNR2GAAKDM4EHPGDALDH1A1

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 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030191069-A1 2-oxoquinoline compounds and pharmaceutical uses thereof JAPAN TOBACCO, INC (JP) 2003-10-09 — — US claimed
US-6509352-B1 Selectively act on cannabinoid receptors, particularly on peripheral type cannabinoid receptors, and have fewer side effects on the central nervous system, having great immunosuppressive action, anti-inflammatory action or JAPAN TOBACCO INC. (JP) 2003-01-21 — — US claimed
EP-1142877-A1 2-OXOQUINOLINE COMPOUNDS AND MEDICINAL USES THEREOF JAPAN TOBACCO INC. (JP) 2001-10-10 — — EP claimed
EP-2130820-A1 Antipruritics SHIONOGI & CO., LTD. (JP) 2009-12-09 — — EP disclosed
US-20080312292-A1 Antipruritics YASUI KIYOSHI 2008-12-18 — — US disclosed
US-20050101590-A1 Cannabinoid receptor agonists SHIONOGI & CO., LTD. (JP) 2005-05-12 — — US disclosed
EP-1477186-A1 ANTIPRURITICS SHIONOGI & CO., LTD. (JP) 2004-11-17 — — EP disclosed
US-6806276-B2 SIDE EFFECT REDUCTION ON CENTRAL NERVOUS SYSTEM; IMMUNOSUPPRESSANTS; ANTIINFLAMMATORY AGENTS; ANTIALLERGENS JAPAN TOBACCO INC. (JP) 2004-10-19 — — US disclosed
US-20030232855-A1 Therapeutic agent for allergic disease JAPAN TOBACCO INC. 2003-12-18 — — US disclosed
US-20030191069-A1 2-oxoquinoline compounds and pharmaceutical uses thereof JAPAN TOBACCO, INC (JP) 2003-10-09 — — US disclosed
US-6509352-B1 Selectively act on cannabinoid receptors, particularly on peripheral type cannabinoid receptors, and have fewer side effects on the central nervous system, having great immunosuppressive action, anti-inflammatory action or JAPAN TOBACCO INC. (JP) 2003-01-21 — — US disclosed
CN-1337950-A 2-oxoquinoline compounds and medicinal uses thereof JAPAN TOBACCO INC (JP) 2002-02-27 — — CN disclosed
EP-1142877-A1 2-OXOQUINOLINE COMPOUNDS AND MEDICINAL USES THEREOF JAPAN TOBACCO INC. (JP) 2001-10-10 — — 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 (4 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-20030232855-A1 Therapeutic agent for allergic disease CNR1, CNR2, HRH4 CNR2 2/4885GAA 3619/4885KDM4E 865/4885
US-20050101590-A1 Cannabinoid receptor agonists CNR1, CNR2, OPRL1 CNR2 2/4885GAA 4063/4885KDM4E 2840/4885
US-20030191069-A1 2-oxoquinoline compounds and pharmaceutical uses thereof CNR2, CNR1, OPRL1 CNR2 1/4885GAA 4692/4885KDM4E 1771/4885
US-20080312292-A1 Antipruritics CNR1, CNR2, OPRL1 CNR2 2/4885GAA 3645/4885KDM4E 3245/4885

“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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