SCHEMBL5367772

SCHEMBL5367772

C/C(=N\O)c1ccc(C(=O)O)s1

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ DAO P14920 6/20 0.52
▸ PKM P14618 2/20 0.47
▸ LIG1 P18858 1/20 0.47
▸ ALDH1A1 P00352 2/20 0.47
▸ POLB P06746 2/20 0.47
▸ GAA P10253 2/20 0.43
▸ MAPT P10636 1/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ HPGD P15428 1/20 0.41
▸ MEN1 O00255 2/20 0.40
▸ RAB9A P51151 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ NPC1 O15118 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
SCHEMBL5367777 1.00 DAO (0.52) DAOPKMLIG1ALDH1A1POLB
SCHEMBL2407263 0.82 NPSR1 (0.51) PKMALDH1A1POLBGAAMAPT
SCHEMBL2407264 0.82 NPSR1 (0.51) PKMALDH1A1POLBGAAMAPT
SCHEMBL70493 0.79 DAO (0.67) DAOPKMLIG1ALDH1A1POLB
SCHEMBL10738386 0.79 DAO (0.47) DAOPKMLIG1ALDH1A1POLB
SCHEMBL593258 0.78 DAO (0.60) DAOPKMLIG1ALDH1A1POLB
Hydrochloric Acid SCHEMBL3074364 0.77 DAO (0.64) DAOPKMLIG1ALDH1A1POLB
SCHEMBL11598753 0.77 DAO (0.64) DAOPKMLIG1ALDH1A1POLB
SCHEMBL28353716 0.77 DAO (0.64) DAOPKMLIG1ALDH1A1POLB
SCHEMBL19987844 0.77 DAO (0.64) DAOPKMLIG1ALDH1A1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7217723-B2 Substituted benzothiophenes, e.g., 7Z)-7-hydroxyimino-4,5,6,7-tetrahydro-benzo[b]thiophene-3-sulfonic acid [2-(4-fluorophenyl)-2-hydroxyethyl]-methyl-amide; treating allergies such as atopic dermatitis, allergic coryza, bronchial asthma, hypersensitive pneumoniac and pulmonary aspergillosis. EISAI CO., LTD. (JP) 2007-05-15 — — US disclosed
US-20050227959-A1 Heterocyclic compound having oxime group EISAI CO., LTD. (JP) 2005-10-13 — — US disclosed
US-20050154048-A1 Novel acyl hydrazino thiophene derivatives, process for preparing them, their use as medicinal products, pharmaceutical compositions and novel use AVENTIS PHARMA S.A. (FR) 2005-07-14 — — US 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 (2 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-20050154048-A1 Novel acyl hydrazino thiophene derivatives, process for preparing them, their use as medicinal products, pharmaceutical compositions and novel use CTSZ, CTSE, CTSS DAO 1242/4885PKM 2146/4885LIG1 4783/4885
US-20050227959-A1 Heterocyclic compound having oxime group STAT6, HRH4, HRH2 DAO 2121/4885PKM 2869/4885LIG1 4415/4885

“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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