SCHEMBL5495774

SCHEMBL5495774

O=C1NC(=O)C(N2CCCCC2)N1

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.37
ALDH1A1 P00352 2/20 0.33
KDM4E B2RXH2 1/20 0.33
TDP1 Q9NUW8 1/20 0.32
GAA P10253 1/20 0.30
HPGD P15428 1/20 0.30
HSD17B10 Q99714 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
SCHEMBL6632635 0.98 TSHR (0.38) TSHRALDH1A1KDM4ETDP1
SCHEMBL1809020 0.94 TSHR (0.38) TSHRALDH1A1KDM4ETDP1
SCHEMBL7534039 0.75 BRD4 (0.33) TSHRTDP1
SCHEMBL19011596 0.71
SCHEMBL181531 0.65 TSHR (0.35) TSHRALDH1A1TDP1
SCHEMBL19858947 0.64 TDP1 (0.32) TSHRTDP1
SCHEMBL11363682 0.64 TSHR (0.34) TSHRTDP1
SCHEMBL10436985 0.64 ALDH1A1 (0.49) ALDH1A1KDM4EGAAHPGDHSD17B10
SCHEMBL9838534 0.63 MEN1 (0.35) TSHRTDP1
SCHEMBL29290644 0.62 KMT2A (0.57) TSHRALDH1A1KDM4ETDP1GAA

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-7262163-B2 Short amphipathic peptides with activity against bacteria and intracellular pathogens BOARD OF SUPERVISORS OF LOUISIANA STATE UNIVERSITY AND AGRICULTURAL AND MECHANICAL COLLEGE (US) 2007-08-28 US disclosed
US-20040059088-A1 Short amphipathic peptides with activity against bacteria and intracellular pathogens MCLAUGHLIN MARK L (US) 2004-03-25 US disclosed
US-6566334-B1 For therapy of bacterial infection BOARD OF SUPERVISORS OF LOUISIANA STATE UNIVERSITY AND AGRICULTURAL AND MECHANICAL COLLEGE 2003-05-20 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 (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-20040059088-A1 Short amphipathic peptides with activity against bacteria and intracellular pathogens VIP, MDK, HM13 TSHR 3436/4885ALDH1A1 4846/4885KDM4E 4672/4885

“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.