SCHEMBL4625372

SCHEMBL4625372

C1COCCOCCOCCOCCOCCO1.COCCOC

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TTR P02766 1/20 0.43
TDP1 Q9NUW8 1/20 0.35
KDM1A O60341 1/20 0.32
TSHR P16473 1/20 0.31
LMNA P02545 1/20 0.30
POLB P06746 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
MEN1 O00255 2/20 0.30
KMT2A Q03164 2/20 0.30
GAA P10253 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
Dioxane SCHEMBL2949971 1.00 TTR (0.43) TTRTDP1KDM1ATSHRLMNA
Dioxane SCHEMBL10324821 0.91 CA2 (0.35) TTRTDP1
Dioxane SCHEMBL8149387 0.91 CA2 (0.35) TTRTDP1
Dioxane SCHEMBL3104036 0.91 CA2 (0.35) TTRTDP1
SCHEMBL3743823 0.87
Tetrahydrofuran SCHEMBL2361115 0.87 ALDH1A1 (0.50) TDP1KDM1A
Dioxane SCHEMBL299082 0.86 TDP1 (0.34) TTRTDP1TSHRLMNAGAA
SCHEMBL7703561 0.84 ALDH1A1 (0.47) TDP1
SCHEMBL6814772 0.84 ALDH1A1 (0.47) TDP1
Tetrahydrofuran SCHEMBL5235661 0.84 ALDH1A1 (0.47) TDP1

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
EP-1181299-B1 C-2 MODIFIED ERYTHROMYCIN DERIVATIVES ABBOTT LAB (US) 2008-06-18 EP disclosed
US-20020193320-A1 C-2 modified erythromycin derivatives ABBOTT LABORATORIES 2002-12-19 US disclosed
EP-1181299-A1 C-2 MODIFIED ERYTHROMYCIN DERIVATIVES Abbott Laboratories (US) 2002-02-27 EP disclosed
WO-2000069875-A9 C-2 MODIFIED ERYTHROMYCIN DERIVATIVES ABBOTT LAB (US) 2002-02-21 WO disclosed
WO-2000069875-A1 C-2 MODIFIED ERYTHROMYCIN DERIVATIVES ABBOTT LABORATORIES (US) 2000-11-23 WO 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-20020193320-A1 C-2 modified erythromycin derivatives CYP2D6, CYP1A2, CYP2B6 TTR 2537/4885TDP1 3802/4885KDM1A 2703/4885

“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.