SCHEMBL862262

SCHEMBL862262

CCOC(=O)CSc1ncn(C)c1-c1cccc2ccccc12

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRNP P04156 7/20 0.52
RXFP1 Q9HBX9 6/20 0.52
TSHR P16473 1/20 0.52
NPSR1 Q6W5P4 1/20 0.52
L3MBTL1 Q9Y468 4/20 0.51
CYP1A2 P05177 1/20 0.51
POLB P06746 1/20 0.51
CYP2C9 P11712 1/20 0.51
CYP2C19 P33261 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
ALDH1A1 P00352 4/20 0.50
SMN1; SMN2 Q16637 3/20 0.50
HPGD P15428 3/20 0.49
MAPT P10636 2/20 0.49
KDM4E B2RXH2 2/20 0.48
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
ABCB1 P08183 1/20 0.47
ELANE P08246 1/20 0.46
TP53 P04637 1/20 0.46

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
SCHEMBL860747 0.85 USP2 (0.46) PRNPRXFP1L3MBTL1CYP1A2POLB
SCHEMBL847350 0.76 PRNP (0.51) PRNPRXFP1TSHRNPSR1L3MBTL1
SCHEMBL857677 0.74 TYMS (0.53) PRNPRXFP1TSHRNPSR1L3MBTL1
SCHEMBL28702281 0.72 ALDH1A1 (0.63) PRNPRXFP1TSHRNPSR1L3MBTL1
SCHEMBL845526 0.70 ALDH1A1 (0.47) PRNPRXFP1TSHRNPSR1L3MBTL1
SCHEMBL845616 0.70 ALDH1A1 (0.47) PRNPRXFP1TSHRNPSR1L3MBTL1
SCHEMBL860937 0.69 TYMS (0.50) PRNPRXFP1TSHRNPSR1L3MBTL1
SCHEMBL17141930 0.68 ALDH1A1 (0.63) PRNPRXFP1TSHRNPSR1L3MBTL1
SCHEMBL28339660 0.67 RXFP1 (0.64) PRNPRXFP1TSHRNPSR1L3MBTL1
SCHEMBL19851100 0.67 TSHR (0.66) TSHRNPSR1CYP1A2CYP2C9ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120122780-A1 Compounds, Compositions and Methods for Modulating Uric Acid Levels ARDEA BIOSCIENCES INC. (US) 2012-05-17 US disclosed
US-20120122780-A1 Compounds, Compositions and Methods for Modulating Uric Acid Levels ARDEA BIOSCIENCES INC. (US) 2012-05-17 US disclosed
US-20120122780-A1 Compounds, Compositions and Methods for Modulating Uric Acid Levels ARDEA BIOSCIENCES INC. (US) 2012-05-17 US disclosed
EP-2432774-A2 COMPOUNDS, COMPOSITIONS AND METHODS FOR MODULATING URIC ACID LEVELS Ardea Biosciences, Inc. (US) 2012-03-28 EP disclosed
WO-2010135530-A2 COMPOUNDS, COMPOSITIONS AND METHODS FOR MODULATING URIC ACID LEVELS ARDEA BIOSCIENCES, INC. (US) 2010-11-25 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-20120122780-A1 Compounds, Compositions and Methods for Modulating Uric Acid Levels XDH, PON1, RBP4 PRNP 1743/4885RXFP1 358/4885TSHR 3835/4885

“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.