SCHEMBL5604542

SCHEMBL5604542

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nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 6/20 0.41
ALDH1A1 P00352 1/20 0.39
HIF1A Q16665 4/20 0.35
EPAS1 Q99814 4/20 0.35
MEN1 O00255 1/20 0.32
CYP3A4 P08684 1/20 0.32
KMT2A Q03164 1/20 0.32
TSHR P16473 1/20 0.30

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
SCHEMBL14548112 1.00 ALOX15 (0.41) ALOX15ALDH1A1HIF1AEPAS1MEN1
SCHEMBL5605026 1.00 ALOX15 (0.41) ALOX15ALDH1A1HIF1AEPAS1MEN1
SCHEMBL5604410 1.00 ALOX15 (0.41) ALOX15ALDH1A1HIF1AEPAS1MEN1
SCHEMBL5604842 0.87 ALOX15 (0.42) ALOX15ALDH1A1HIF1AEPAS1MEN1
SCHEMBL5604602 0.87 ALOX15 (0.42) ALOX15ALDH1A1HIF1AEPAS1MEN1
SCHEMBL5604592 0.87 ALOX15 (0.42) ALOX15ALDH1A1HIF1AEPAS1MEN1
SCHEMBL29052095 0.75 ALOX15 (0.47) ALOX15ALDH1A1HIF1AEPAS1TSHR
SCHEMBL626649 0.72 ALOX15 (0.45) ALOX15HIF1AEPAS1
SCHEMBL11209137 0.72 ALOX15 (0.52) ALOX15ALDH1A1TSHR
SCHEMBL988359 0.71 ALOX15 (0.59) ALOX15HIF1AEPAS1MEN1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8642663-B2 Acetals as insect repellant agents BENCSITS FRANZ (AT) 2014-02-04 US claimed
EP-1567013-B1 ACETALS AS INSECT REPELLANT AGENTS BENCSITS FRANZ (AT) 2007-04-18 EP claimed
US-20050249767-A1 Acetals as insect repellant agents BENCSITS FRANZ 2005-11-10 US claimed
EP-1567013-A1 ACETALS AS INSECT REPELLANT AGENTS Bencsits, Franz (AT) 2005-08-31 EP claimed
WO-2004039158-A1 ACETALS AS INSECT REPELLANT AGENTS BENCSITS FRANZ (AT) 2004-05-13 WO claimed

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-20050249767-A1 Acetals as insect repellant agents API5, AADAC, NAAA ALOX15 2663/4885ALDH1A1 568/4885HIF1A 3547/4885

“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.