SCHEMBL20072647

SCHEMBL20072647

C=C(C)[C@@H]1CC[C@]2(C(=O)NO)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC/C(=N\O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EGLN2 Q96KS0 5/20 1.00
▸ EGLN1 Q9GZT9 5/20 1.00
▸ EGLN3 Q9H6Z9 5/20 1.00
▸ P4HTM Q9NXG6 5/20 1.00
▸ GPBAR1 Q8TDU6 6/20 0.68
▸ LMNA P02545 2/20 0.65
▸ NT5E P21589 2/20 0.65
▸ SMN1; SMN2 Q16637 1/20 0.65
▸ ALB P02768 2/20 0.54
▸ PTPN1 P18031 2/20 0.54
▸ GLI1 P08151 2/20 0.54
▸ RORC P51449 2/20 0.54
▸ USP2 O75604 1/20 0.54
▸ HIF1A Q16665 1/20 0.54
▸ AKR1B10 O60218 1/20 0.54
▸ POLB P06746 1/20 0.54
▸ AKR1B1 P15121 1/20 0.54
▸ DPP4 P27487 1/20 0.54
▸ SAE1 Q9UBE0 1/20 0.54
▸ UBA2 Q9UBT2 1/20 0.54

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
SCHEMBL20072718 1.00 EGLN2 (1.00) EGLN2EGLN1EGLN3P4HTMGPBAR1
SCHEMBL13293163 0.91 EGLN2 (0.83) EGLN2EGLN1EGLN3P4HTMGPBAR1
SCHEMBL14086933 0.91 EGLN2 (0.83) EGLN2EGLN1EGLN3P4HTMGPBAR1
SCHEMBL2620462 0.84 EGLN2 (0.72) EGLN2EGLN1EGLN3P4HTMGPBAR1
SCHEMBL21435975 0.83 GPBAR1 (0.71) EGLN2EGLN1EGLN3P4HTMGPBAR1
SCHEMBL21435881 0.82 EGLN2 (0.69) EGLN2EGLN1EGLN3P4HTMGPBAR1
SCHEMBL20072644 0.81 EGLN2 (0.68) EGLN2EGLN1EGLN3P4HTMGPBAR1
SCHEMBL13098071 0.81 EGLN2 (0.68) EGLN2EGLN1EGLN3P4HTMGPBAR1
Betulin-3,28-Dioxime SCHEMBL13098079 0.81 SLC10A1 (0.69) EGLN2EGLN1EGLN3P4HTMGPBAR1
SCHEMBL13293178 0.81 GPBAR1 (0.69) EGLN2EGLN1EGLN3P4HTMGPBAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10766855-B2 Hydroxamate triterpenoid derivatives VIVACELL BIOTECHNOLOGY ESPAÑA, S.L. (ES) 2020-09-08 — — US disclosed
WO-2018069086-A1 HYDROXAMATE TRITERPENOID DERIVATIVES VIVACELL BIOTECHNOLOGY ESPAÑA S.L. (ES) 2018-04-19 — — 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-10766855-B2 Hydroxamate triterpenoid derivatives STAT3, EPOR, TXNRD2 EGLN2 10/4885EGLN1 34/4885EGLN3 7/4885

“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.

Send feedback