SCHEMBL26093034

SCHEMBL26093034

C[C@H]1CC[C@H](C(=O)C=[N+]=[N-])CC1

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.32
MEN1 O00255 1/20 0.32
HTT P42858 1/20 0.32
KMT2A Q03164 1/20 0.32
HIF1A Q16665 1/20 0.32
THRA P10827 1/20 0.32
THRB P10828 1/20 0.32
EPHX1 P07099 1/20 0.31
NPC1 O15118 1/20 0.31
USP2 O75604 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
SCHEMBL11087187 0.89
SCHEMBL15274590 0.83
SCHEMBL21805094 0.81 PLG (0.39) MEN1KMT2ANPC1
SCHEMBL14892803 0.79 TP53 (0.40) ALDH1A1NPC1
SCHEMBL11075590 0.79 ROCK2 (0.36) ALDH1A1MEN1HTTKMT2AHIF1A
SCHEMBL20501606 0.79 TP53 (0.40) ALDH1A1NPC1
SCHEMBL11086822 0.79 ROCK2 (0.36) ALDH1A1MEN1HTTKMT2AHIF1A
SCHEMBL14892804 0.79 TP53 (0.40) ALDH1A1NPC1
SCHEMBL1742470 0.78 CES2 (0.44) ALDH1A1EPHX1NPC1
SCHEMBL10500490 0.76 NR3C2 (0.34) ALDH1A1MEN1HTTKMT2AHIF1A

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
CN-118139868-A Orally bioavailable nucleoside analogs 维纳拓尔斯制药公司 2024-06-04 CN disclosed
US-11638715-B2 Orally-bioavailable nucleoside analogs VenatoRx Pharmaceuticals, Inc. (US) 2023-05-02 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-11638715-B2 Orally-bioavailable nucleoside analogs SLC29A2, SLC29A1, PNP ALDH1A1 2219/4885MEN1 4140/4885HTT 2401/4885

“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.