SCHEMBL21265742

SCHEMBL21265742

COC(=O)Nc1nc2cc(C(=O)c3ccccc3)ccc2n1COC(=O)C(C)(C)C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EHMT2 Q96KQ7 2/20 0.46
CYP2C9 P11712 2/20 0.44
USP2 O75604 2/20 0.44
LMNA P02545 2/20 0.44
ABCC4 O15439 1/20 0.44
ALDH1A1 P00352 1/20 0.44
ABL1 P00519 1/20 0.44
CYP1A2 P05177 1/20 0.44
KDR P35968 1/20 0.44
HTT P42858 1/20 0.44
HIF1A Q16665 1/20 0.44
EHMT1 Q9H9B1 1/20 0.43
ITK Q08881 4/20 0.41
BRD4 O60885 1/20 0.41
KDM4E B2RXH2 4/20 0.40
NPSR1 Q6W5P4 2/20 0.40
RAB9A P51151 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
MAP4K4 O95819 1/20 0.40
CSF1R P07333 1/20 0.40

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
SCHEMBL21265743 0.88 EHMT2 (0.51) EHMT2CYP2C9USP2LMNAABCC4
SCHEMBL25887858 0.87 EHMT2 (0.47) EHMT2CYP2C9USP2LMNAABCC4
SCHEMBL21265754 0.86 EHMT2 (0.43) EHMT2CYP2C9USP2LMNAABCC4
Hydrochloric Acid SCHEMBL23610932 0.85 EHMT2 (0.46) EHMT2CYP2C9USP2LMNAABCC4
SCHEMBL23619186 0.85 EHMT2 (0.46) EHMT2CYP2C9USP2LMNAABCC4
SCHEMBL21265764 0.85 EHMT2 (0.46) EHMT2CYP2C9USP2LMNAABCC4
SCHEMBL30514375 0.85 BRD4 (0.48) EHMT2CYP2C9USP2LMNAABCC4
SCHEMBL21265744 0.85 BRD4 (0.48) EHMT2CYP2C9USP2LMNAABCC4
SCHEMBL30514369 0.85 EHMT2 (0.45) EHMT2CYP2C9USP2LMNAABCC4
SCHEMBL21265863 0.85 EHMT2 (0.45) EHMT2CYP2C9USP2LMNAABCC4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11712435-B2 Mebendazole prodrugs with enhanced solubility and oral bioavailability THE JOHNS HOPKINS UNIVERSITY (US) 2023-08-01 US disclosed
US-11712435-B2 Mebendazole prodrugs with enhanced solubility and oral bioavailability THE JOHNS HOPKINS UNIVERSITY (US) 2023-08-01 US disclosed
US-11712435-B2 Mebendazole prodrugs with enhanced solubility and oral bioavailability THE JOHNS HOPKINS UNIVERSITY (US) 2023-08-01 US disclosed
US-20210205271-A1 MEBENDAZOLE PRODRUGS WITH ENHANCED SOLUBILITY AND ORAL BIOAVAILABILITY INSTITUTE OF ORGANIC CHEMISTRY AND BIOCHEMISTRY AS CR V.V.I. 2021-07-08 US disclosed
US-20210205271-A1 MEBENDAZOLE PRODRUGS WITH ENHANCED SOLUBILITY AND ORAL BIOAVAILABILITY INSTITUTE OF ORGANIC CHEMISTRY AND BIOCHEMISTRY AS CR V.V.I. 2021-07-08 US disclosed
WO-2019157338-A1 MEBENDAZOLE PRODRUGS WITH ENHANCED SOLUBILITY AND ORAL BIOAVAILABILITY THE JOHNS HOPKINS UNIVERSITY (US) 2019-08-15 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 (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-11712435-B2 Mebendazole prodrugs with enhanced solubility and oral bioavailability CYP3A43, CYP3A4, CYP4B1 EHMT2 3071/4885CYP2C9 23/4885USP2 2299/4885
US-20210205271-A1 MEBENDAZOLE PRODRUGS WITH ENHANCED SOLUBILITY AND ORAL BIOAVAILABILITY CYP3A43, CYP3A4, CYP4B1 EHMT2 3071/4885CYP2C9 23/4885USP2 2299/4885

“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.