SCHEMBL24029051

SCHEMBL24029051

O=C(O)c1ccc(-n2nnnc2SC[C@H](O)c2ccc([N+](=O)[O-])cc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 7/20 0.53
▸ KMT2A Q03164 7/20 0.53
▸ POLB P06746 3/20 0.53
▸ THRB P10828 1/20 0.53
▸ HPGD P15428 3/20 0.53
▸ HTT P42858 3/20 0.51
▸ RECQL P46063 1/20 0.50
▸ ALDH1A1 P00352 4/20 0.48
▸ MAPK1 P28482 3/20 0.48
▸ PPARG P37231 1/20 0.48
▸ NPSR1 Q6W5P4 1/20 0.46
▸ MAPT P10636 2/20 0.45
▸ PKM P14618 2/20 0.45
▸ GAA P10253 1/20 0.45
▸ TDP1 Q9NUW8 2/20 0.44
▸ LMNA P02545 1/20 0.44
▸ ATM Q13315 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL24019625 1.00 MEN1 (0.53) MEN1KMT2APOLBTHRBHPGD
SCHEMBL24029052 1.00 MEN1 (0.53) MEN1KMT2APOLBTHRBHPGD
SCHEMBL28669731 0.85 MAPK1 (0.60) MEN1KMT2APOLBTHRBHPGD
SCHEMBL28655968 0.85 KMT2A (0.58) MEN1KMT2APOLBHPGDALDH1A1
SCHEMBL19334400 0.83 MEN1 (0.62) MEN1KMT2APOLBTHRBHPGD
SCHEMBL28660621 0.82 SMN1; SMN2 (0.58) MEN1KMT2APOLBHPGDHTT
SCHEMBL28654833 0.82 HPGD (0.54) MEN1KMT2APOLBTHRBHPGD
SCHEMBL28673736 0.82 HPGD (0.53) MEN1KMT2APOLBHPGDALDH1A1
SCHEMBL28676731 0.80 HPGD (0.51) MEN1KMT2AHPGDRECQLALDH1A1
SCHEMBL28669425 0.80 HPGD (0.53) MEN1KMT2APOLBTHRBHPGD

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-20230181535-A1 UBIQUITIN-LIGASE INHIBITORS FOR THE TREATMENT OF CANCER FUND PROFESOR NOVOA SANTOS (ES) 2023-06-15 — — US disclosed
WO-2021229035-A1 UBIQUITIN-LIGASE INHIBITORS FOR THE TREATMENT OF CANCER FUNDACIÓN PROFESOR NOVOA SANTOS (ES) 2021-11-18 — — 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-20230181535-A1 UBIQUITIN-LIGASE INHIBITORS FOR THE TREATMENT OF CANCER XIAP, UBQLN1, MDM2 MEN1 3372/4885KMT2A 663/4885POLB 1121/4885

“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.

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