SCHEMBL16264367

SCHEMBL16264367

O=C(NC(=O)c1ccsc1NC(=O)c1ccnc(NC(=O)N2CCOCC2)c1)OCCF

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
MAPT P10636 4/20 0.41
GSK3B P49841 4/20 0.41
CYP2C9 P11712 2/20 0.41
GAA P10253 1/20 0.39
HTT P42858 1/20 0.39
KCNH2 Q12809 1/20 0.36
ALDH1A1 P00352 1/20 0.36
AXL P30530 1/20 0.36
ADORA2A P29274 1/20 0.36
ADORA1 P30542 1/20 0.36
KDM4E B2RXH2 1/20 0.35
DYRK1A Q13627 1/20 0.35

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
SCHEMBL17903914 0.92 KCNH2 (0.43) MEN1KMT2AMAPTCYP2C9KCNH2
SCHEMBL16264478 0.90 CYP2C9 (0.52) MEN1KMT2AMAPTGSK3BCYP2C9
SCHEMBL16264377 0.81 CYP2C9 (0.54) MEN1KMT2AMAPTCYP2C9KCNH2
SCHEMBL16264365 0.81 CYP2C9 (0.54) MEN1KMT2AMAPTCYP2C9KCNH2
SCHEMBL16264633 0.81 CYP2C9 (0.45) MAPTGSK3BCYP2C9KDM4E
SCHEMBL16264345 0.81 MAPT (0.49) MEN1KMT2AMAPTGSK3BCYP2C9
SCHEMBL16264381 0.80 CYP2C9 (0.51) MEN1KMT2AMAPTGSK3BCYP2C9
SCHEMBL17903916 0.80 CYP2C9 (0.50) MEN1KMT2AMAPTGSK3BCYP2C9
SCHEMBL17903632 0.79 CYP2C9 (0.51) MEN1KMT2AMAPTCYP2C9KCNH2
SCHEMBL17905898 0.79 CYP2C9 (0.51) MEN1KMT2AMAPTGSK3BCYP2C9

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-20160194299-A1 COMPOUNDS FOR TREATMENT OF DRUG RESISTANT AND PERSISTENT TUBERCULOSIS THE CALIFORNIA INSTITUTE FOR BIOMEDICAL RESEARCH 2016-07-07 US disclosed
US-20160194299-A1 COMPOUNDS FOR TREATMENT OF DRUG RESISTANT AND PERSISTENT TUBERCULOSIS THE CALIFORNIA INSTITUTE FOR BIOMEDICAL RESEARCH 2016-07-07 US disclosed
WO-2014190199-A1 COMPOUNDS FOR TREATMENT OF DRUG RESISTANT AND PERSISTENT TUBERCULOSIS THE CALIFORNIA INSTITUTE FOR BIOMEDICAL RESEARCH (US) 2014-11-27 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-20160194299-A1 COMPOUNDS FOR TREATMENT OF DRUG RESISTANT AND PERSISTENT TUBERCULOSIS FNTB, PGLS, EP300 MEN1 3943/4885KMT2A 3579/4885MAPT 1082/4885

“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.