SCHEMBL1079499

SCHEMBL1079499

CCOC(=O)Cc1c(Cl)nc(N)nc1NCc1nn(CC)cc1Cl

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 17/20 0.36
KDM4E B2RXH2 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
MAPK1 P28482 1/20 0.34
RECQL P46063 1/20 0.34

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
SCHEMBL1077526 0.77 ALDH1A1 (0.38) TLR7KDM4ETDP1L3MBTL1MAPK1
SCHEMBL1078774 0.77 TSHR (0.36) TLR7KDM4ETDP1L3MBTL1MAPK1
SCHEMBL1080379 0.77 NLRP3 (0.41) TLR7KDM4ETDP1L3MBTL1
SCHEMBL1059505 0.75 L3MBTL1 (0.54) KDM4ETDP1L3MBTL1MAPK1RECQL
SCHEMBL1054301 0.74 HSP90AA1 (0.46) TLR7
SCHEMBL1788256 0.74 CYP3A4 (0.38) TLR7KDM4ETDP1MAPK1
SCHEMBL1055154 0.72 MAPK1 (0.53) KDM4ETDP1L3MBTL1MAPK1
SCHEMBL1061420 0.71 MAPT (0.42) TLR7KDM4ETDP1L3MBTL1MAPK1
SCHEMBL1059523 0.71 HSP90AA1 (0.43) TLR7KDM4E
SCHEMBL1058303 0.71 TLR7 (0.39) TLR7MAPK1

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-20110124634-A1 BIOACTIVE COMPOUNDS FOR TREATMENT OF CANCER AND NEURODEGENERATIVE DISEASES PONIARD PHARMACEUTICALS, INC. 2011-05-26 US disclosed
EP-2273882-A1 BIOACTIVE COMPOUNDS FOR TREATMENT OF CANCER AND NEURODEGENERATIVE DISEASES Poniard Pharmaceuticals, Inc. (US) 2011-01-19 EP disclosed
WO-2009139834-A1 BIOACTIVE COMPOUNDS FOR TREATMENT OF CANCER AND NEURODEGENERATIVE DISEASES PONIARD PHARMACEUTICALS, INC. (US) 2009-11-19 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-20110124634-A1 BIOACTIVE COMPOUNDS FOR TREATMENT OF CANCER AND NEURODEGENERATIVE DISEASES PARK7, BDNF, BACE1 TLR7 4464/4885KDM4E 3340/4885TDP1 974/4885

“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.