SCHEMBL16264408

SCHEMBL16264408

CCOC(=O)N(C)C(=O)c1ccsc1NC(=O)c1ccnc(NC(C)=O)c1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 3/20 0.42
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
PKM P14618 1/20 0.39
ACACB O00763 1/20 0.38
PIK3C3 Q8NEB9 2/20 0.38
FLT3 P36888 1/20 0.38
KDM4E B2RXH2 2/20 0.37
TDP1 Q9NUW8 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
LMNA P02545 1/20 0.37
HPGD P15428 1/20 0.37
GSK3A P49840 1/20 0.36
GSK3B P49841 1/20 0.36

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
SCHEMBL16264498 0.85 PIK3C3 (0.49) NPC1RAB9ASMN1; SMN2PIK3C3FLT3
SCHEMBL16264472 0.84 CYP2C9 (0.58) CYP2C9NPC1RAB9ASMN1; SMN2PKM
SCHEMBL17906067 0.83 RAB9A (0.46) CYP2C9NPC1RAB9ASMN1; SMN2PKM
SCHEMBL16264394 0.78 MAPK10 (0.57) NPC1RAB9ASMN1; SMN2PIK3C3FLT3
SCHEMBL16264546 0.77 CYP2C9 (0.58) CYP2C9NPC1RAB9ASMN1; SMN2PKM
SCHEMBL16264468 0.76 CYP2C9 (0.55) CYP2C9KDM4ETDP1L3MBTL1
SCHEMBL17903908 0.75 CYP2C9 (0.56) CYP2C9NPC1RAB9ASMN1; SMN2PKM
SCHEMBL16264374 0.74 CYP2C9 (0.55) CYP2C9NPC1RAB9ASMN1; SMN2PKM
SCHEMBL17906100 0.74 CYP2C9 (0.55) CYP2C9NPC1RAB9ASMN1; SMN2PKM
SCHEMBL16264474 0.74 CYP2C9 (0.55) CYP2C9NPC1RAB9ASMN1; SMN2PKM

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-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 CYP2C9 1792/4885NPC1 386/4885RAB9A 1274/4885

“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.