SCHEMBL1059979

SCHEMBL1059979

CCOC(=O)Cc1c(O)nc(N)nc1C(F)(F)F

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.48
MAPK1 P28482 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.40
TRPM8 Q7Z2W7 1/20 0.38
ALDH1A1 P00352 3/20 0.37
TSHR P16473 2/20 0.37
GAA P10253 1/20 0.37
IDO1 P14902 1/20 0.37
HSD17B10 Q99714 2/20 0.36
USP2 O75604 1/20 0.36
HPGD P15428 2/20 0.36
KMT2A Q03164 1/20 0.35
CHEK1 O14757 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
SCHEMBL1058836 0.86 KDM4E (0.48) KDM4EMAPK1SMN1; SMN2ALDH1A1TSHR
SCHEMBL1060382 0.85 MAPK1 (0.56) KDM4EMAPK1SMN1; SMN2TRPM8ALDH1A1
SCHEMBL1034112 0.81 MAPK1 (0.52) KDM4EMAPK1SMN1; SMN2TRPM8ALDH1A1
SCHEMBL30932476 0.77 KDM4E (0.38) KDM4EMAPK1
SCHEMBL29223352 0.77 KDM4E (0.38) KDM4EMAPK1
SCHEMBL27289016 0.73 SMN1; SMN2 (0.46) KDM4EMAPK1SMN1; SMN2ALDH1A1TSHR
SCHEMBL1055154 0.72 MAPK1 (0.53) KDM4EMAPK1SMN1; SMN2ALDH1A1TSHR
SCHEMBL27293094 0.72 MAPK1 (0.53) KDM4EMAPK1SMN1; SMN2ALDH1A1TSHR
SCHEMBL12480437 0.72 MAPK1 (0.51) KDM4EMAPK1SMN1; SMN2TRPM8ALDH1A1
SCHEMBL26620725 0.71 KDM4E (0.59) KDM4ESMN1; SMN2ALDH1A1GAAIDO1

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
CN-102098918-A Bioactive compounds for treatment of cancer and neurodegenerative diseases PONIARD PHARMACEUTICALS INC 2011-06-15 CN disclosed
US-20110124634-A1 BIOACTIVE COMPOUNDS FOR TREATMENT OF CANCER AND NEURODEGENERATIVE DISEASES PONIARD PHARMACEUTICALS, INC. 2011-05-26 US disclosed
US-20110124634-A1 BIOACTIVE COMPOUNDS FOR TREATMENT OF CANCER AND NEURODEGENERATIVE DISEASES PONIARD PHARMACEUTICALS, INC. 2011-05-26 US disclosed
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 KDM4E 3340/4885MAPK1 1938/4885SMN1; SMN2 11/4885

“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.