SCHEMBL17016708

SCHEMBL17016708

Cc1cn(CC(Cn2ccc(=O)[nH]c2=O)OC=O)c(=O)[nH]c1=O

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ TYMP P19971 3/20 0.47
▸ PKM P14618 1/20 0.46
▸ MAPK1 P28482 1/20 0.44
▸ TK1 P04183 4/20 0.43
▸ HPGD P15428 1/20 0.43
▸ TK2 O00142 2/20 0.40

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
SCHEMBL17016481 0.82 PKM (0.50) TYMPPKMMAPK1TK1HPGD
SCHEMBL18358008 0.81 PKM (0.45) TYMPPKMMAPK1TK1HPGD
SCHEMBL17016484 0.79 DUT (0.51) TYMPPKMMAPK1TK1HPGD
SCHEMBL17016710 0.77 TK1 (0.52) TYMPPKMMAPK1TK1HPGD
SCHEMBL17016482 0.77 PKM (0.45) TYMPPKMMAPK1TK1HPGD
SCHEMBL16485723 0.75 TK1 (0.42) TYMPMAPK1TK1HPGD
SCHEMBL16263428 0.74 TK2 (0.53) TYMPMAPK1TK1HPGDTK2
SCHEMBL16263427 0.74 MAPK1 (0.48) TYMPMAPK1TK1HPGDTK2
SCHEMBL18357541 0.72 MAPK1 (0.49) TYMPMAPK1TK1HPGD
SCHEMBL17016636 0.71 TK1 (0.46) TYMPMAPK1TK1HPGDTK2

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-20170000712-A1 SUNLESS TANNING COMPOUNDS AND COMPOSITIONS REGENTS OF THE UNIVERSITY OF MINNESOTA (US) 2017-01-05 — — US disclosed
US-9364406-B2 Open chained or fused 1,1′-alkylene-bis-uracil derivatives, useful in skin UV-protection REGENTS OF THE UNIVERSITY OF MINNESOTA (US) 2016-06-14 — — US disclosed
US-20150231051-A1 OPEN CHAINED OR FUSED 1,1 '-ALKYLENE-BIS-URACIL DERIVATIVES, USEFUL IN SKIN UV-PROTECTION REGENTS OF THE UNIVERSITY OF MINNESOTA (US) 2015-08-20 — — US 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 (2 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-20170000712-A1 SUNLESS TANNING COMPOUNDS AND COMPOSITIONS TYR, SUN2, ERCC4 TYMP 1884/4885PKM 4543/4885MAPK1 1383/4885
US-20150231051-A1 OPEN CHAINED OR FUSED 1,1 '-ALKYLENE-BIS-URACIL DERIVATIVES, USEFUL IN SKIN UV-PROTECTION UNG, ERCC1, ERCC2 TYMP 115/4885PKM 4075/4885MAPK1 1573/4885

“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.

Send feedback