SCHEMBL24209741

SCHEMBL24209741

O=C(O)c1ccc(-n2nnnc2SC2(C(=O)c3ccccc3)CC2)cc1

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 4/20 0.57
▸ MEN1 O00255 6/20 0.52
▸ KMT2A Q03164 6/20 0.52
▸ ALDH1A1 P00352 5/20 0.52
▸ MAPK1 P28482 2/20 0.52
▸ PPARG P37231 1/20 0.52
▸ EP300 Q09472 1/20 0.49
▸ TP53 P04637 1/20 0.47
▸ ATM Q13315 1/20 0.46
▸ NPSR1 Q6W5P4 1/20 0.46
▸ RECQL P46063 1/20 0.46
▸ POLB P06746 3/20 0.45
▸ MAPT P10636 2/20 0.45
▸ TSHR P16473 1/20 0.43
▸ HTT P42858 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
SCHEMBL21952020 0.91 MAPK1 (0.53) HPGDMEN1KMT2AALDH1A1MAPK1
SCHEMBL21952062 0.89 HPGD (0.47) HPGDMEN1KMT2AALDH1A1MAPK1
SCHEMBL21952090 0.87 RECQL (0.53) HPGDMEN1KMT2AALDH1A1MAPK1
SCHEMBL21952003 0.84 MEN1 (0.45) HPGDMEN1KMT2AALDH1A1MAPK1
SCHEMBL24019614 0.79 TSHR (0.53) HPGDMEN1KMT2AALDH1A1MAPK1
SCHEMBL14532498 0.76 HPGD (0.66) HPGDMEN1KMT2AALDH1A1MAPK1
SCHEMBL24210233 0.75 HPGD (0.58) HPGDMEN1KMT2AALDH1A1MAPK1
SCHEMBL24209682 0.74 MAPT (0.71) HPGDMEN1KMT2AALDH1A1MAPK1
SCHEMBL24019594 0.73 TP53 (0.72) HPGDMEN1KMT2AALDH1A1MAPK1
SCHEMBL24019599 0.73 HPGD (1.00) HPGDMEN1KMT2AALDH1A1MAPK1

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-20230181535-A1 UBIQUITIN-LIGASE INHIBITORS FOR THE TREATMENT OF CANCER FUND PROFESOR NOVOA SANTOS (ES) 2023-06-15 — — US disclosed
US-20230181535-A1 UBIQUITIN-LIGASE INHIBITORS FOR THE TREATMENT OF CANCER FUND PROFESOR NOVOA SANTOS (ES) 2023-06-15 — — US disclosed
US-20220016080-A1 COMPOUNDS THAT SELECTIVELY AND EFFECTIVELY INHIBIT HAKAI-MEDIATED UBIQUITINATION, AS ANTI-CANCER DRUGS FUND PROFESOR NOVOA SANTOS (ES) 2022-01-20 — — 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 (2 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 HPGD 2761/4885MEN1 3372/4885KMT2A 663/4885
US-20220016080-A1 COMPOUNDS THAT SELECTIVELY AND EFFECTIVELY INHIBIT HAKAI-MEDIATED UBIQUITINATION, AS ANTI-CANCER DRUGS CHUK, HIPK3, HIPK1 HPGD 1570/4885MEN1 3702/4885KMT2A 2532/4885

“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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