SCHEMBL23497986

SCHEMBL23497986

CCC(=O)N1N=C(c2c(Cc3ccccc3)c3cc(Cl)ccc3[nH]c2=O)CC1c1ccc(OC)cc1

nearest known ligand 0.81

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ RAD51 Q06609 10/20 0.81
▸ ALDH1A1 P00352 3/20 0.69
▸ KDM4E B2RXH2 2/20 0.69
▸ GAA P10253 2/20 0.69
▸ MEN1 O00255 1/20 0.57
▸ XBP1 P17861 1/20 0.57
▸ HTT P42858 1/20 0.57
▸ KMT2A Q03164 1/20 0.57
▸ NPSR1 Q6W5P4 1/20 0.57
▸ MAPT P10636 1/20 0.57
▸ SMN1; SMN2 Q16637 1/20 0.57

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
SCHEMBL30043922 1.00 RAD51 (0.81) RAD51ALDH1A1KDM4EGAAMEN1
SCHEMBL25023426 0.94 RAD51 (0.78) RAD51ALDH1A1KDM4EGAAMEN1
SCHEMBL30175810 0.94 RAD51 (0.78) RAD51ALDH1A1KDM4EGAAMEN1
SCHEMBL30043890 0.94 RAD51 (0.79) RAD51ALDH1A1KDM4EGAAMEN1
SCHEMBL23511050 0.94 RAD51 (0.79) RAD51ALDH1A1KDM4EGAAMEN1
SCHEMBL23510900 0.93 RAD51 (0.75) RAD51ALDH1A1KDM4EGAA
SCHEMBL30045170 0.93 KDM4E (0.81) RAD51ALDH1A1KDM4EGAA
SCHEMBL23498104 0.93 KDM4E (0.81) RAD51ALDH1A1KDM4EGAA
SCHEMBL23510963 0.92 RAD51 (0.76) RAD51ALDH1A1KDM4EGAAMAPT
SCHEMBL30043863 0.92 RAD51 (0.76) RAD51ALDH1A1KDM4EGAAMAPT

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-20230052747-A1 COMPOUNDS AND COMPOSITIONS FOR THE TREATMENT OF TUMORS TES PHARMA S.R.L. (IT) 2023-02-16 — — US disclosed
WO-2021116999-A1 COMPOUNDS AND COMPOSITIONS FOR THE TREATMENT OF TUMORS FONDAZIONE ISTITUTO ITALIANO DI TECNOLOGIA (IT) 2021-06-17 — — WO disclosed
WO-2021116999-A1 COMPOUNDS AND COMPOSITIONS FOR THE TREATMENT OF TUMORS FONDAZIONE ISTITUTO ITALIANO DI TECNOLOGIA (IT) 2021-06-17 — — 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-20230052747-A1 COMPOUNDS AND COMPOSITIONS FOR THE TREATMENT OF TUMORS RAD51, BRCA1, FANCI RAD51 1/4885ALDH1A1 2270/4885KDM4E 4394/4885

“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