SCHEMBL9006882

SCHEMBL9006882

Cc1c(CN2CCCC2)[nH]c(=O)[nH]c1=O

nearest known ligand 0.67

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.67
TYMP P19971 11/20 0.63
PABPC1 P11940 1/20 0.38
MAPT P10636 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.35
ABL1 P00519 1/20 0.35
RIN1 Q13671 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
ALDH1A1 P00352 2/20 0.35
KDM4E B2RXH2 1/20 0.35
MEN1 O00255 1/20 0.34
POLB P06746 1/20 0.34
KMT2A Q03164 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
SCHEMBL1682944 0.80 TYMP (0.65) ALOX15TYMPPABPC1
SCHEMBL9006994 0.79 TYMP (0.63) ALOX15TYMPPABPC1MAPT
SCHEMBL1682985 0.79 TYMP (0.63) ALOX15TYMPMAPT
SCHEMBL1682926 0.75 TYMP (0.59) ALOX15TYMP
SCHEMBL1691006 0.75 TYMP (0.58) ALOX15TYMPPABPC1MAPTALDH1A1
SCHEMBL20799905 0.74 TYMP (0.70) ALOX15TYMPMAPTALDH1A1KDM4E
SCHEMBL14388457 0.71 PNP (0.51) ALOX15TYMP
Hydrochloric Acid SCHEMBL10927079 0.69 ALOX15 (0.54) ALOX15TYMPMAPTL3MBTL1ABL1
SCHEMBL25344146 0.69 TYMP (0.46) ALOX15TYMPL3MBTL1
SCHEMBL6570508 0.69 TYMP (0.46) ALOX15TYMPL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8188105-B2 Therapeutic agent for inflammatory bowel disease comprising uracil derivative as active ingredient TAIHO PHARMACEUTICAL CO., LTD. (JP) 2012-05-29 US disclosed