SCHEMBL4491617

SCHEMBL4491617

CCCCc1oc2ccccc2c1/C(C)=C\C(=O)N1CCN(Cc2ccccc2)CC1

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ EYA3 Q99504 2/20 0.47
▸ PTPN1 P18031 1/20 0.47
▸ TTR P02766 1/20 0.47
▸ SIRT3 Q9NTG7 14/20 0.47
▸ ALDH1A1 P00352 1/20 0.45
▸ MAPT P10636 1/20 0.45
▸ HTT P42858 1/20 0.45
▸ NR1H4 Q96RI1 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
SCHEMBL4491622 1.00 EYA3 (0.47) EYA3PTPN1TTRSIRT3ALDH1A1
SCHEMBL4491614 1.00 EYA3 (0.47) EYA3PTPN1TTRSIRT3ALDH1A1
SCHEMBL4501314 0.80 PTPN1 (0.60) EYA3PTPN1TTRSIRT3NR1H4
SCHEMBL4501308 0.80 PTPN1 (0.60) EYA3PTPN1TTRSIRT3NR1H4
SCHEMBL4501311 0.80 PTPN1 (0.60) EYA3PTPN1TTRSIRT3NR1H4
SCHEMBL4501301 0.75 EYA3 (0.57) EYA3PTPN1TTRSIRT3ALDH1A1
SCHEMBL4501304 0.75 EYA3 (0.57) EYA3PTPN1TTRSIRT3ALDH1A1
SCHEMBL2944813 0.72 PTPN1 (0.69) EYA3PTPN1TTRSIRT3NR1H4
SCHEMBL31314611 0.71 SIRT3 (0.65) EYA3PTPN1TTRSIRT3ALDH1A1
Hydrochloric Acid SCHEMBL9347277 0.71 PTPN1 (0.67) EYA3PTPN1TTRSIRT3ALDH1A1

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-7638540-B2 Benzofuran compound and medicinal composition containing the same THE NEW INDUSTRY RESEARCH ORGANIZATION (JP) 2009-12-29 — — US disclosed
US-20060194851-A1 Benzofuran compound and medicinal composition containing the same NEW INDUSTRY RESEARCH ORGANIZATION, THE (JP) 2006-08-31 — — US disclosed
EP-1627873-A1 BENZOFURAN COMPOUND AND MEDICINAL COMPOSITION CONTAINING THE SAME The New Industry Research Organization (JP) 2006-02-22 — — 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-20060194851-A1 Benzofuran compound and medicinal composition containing the same LTB4R2, LTC4S, LTB4R EYA3 3724/4885PTPN1 2108/4885TTR 4369/4885

“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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