SCHEMBL12711136

SCHEMBL12711136

O=S(=O)(CCCO)C[C@H](c1ccc(F)cc1)c1cccc(OC2CC2)c1

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ TP53 P04637 1/20 0.39
▸ DUT P33316 10/20 0.37
▸ GAA P10253 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ FFAR4 Q5NUL3 1/20 0.34
▸ EPHX2 P34913 1/20 0.34
▸ FFAR1 O14842 5/20 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
SCHEMBL12711105 0.78 DUT (0.47) DUT
SCHEMBL12711128 0.78 DUT (0.45) DUTFFAR1
SCHEMBL12711109 0.74 DUT (0.49) DUT
SCHEMBL12711150 0.74 DUT (0.47) DUT
SCHEMBL13606345 0.73 DUT (0.62) DUT
SCHEMBL12711121 0.72 SRC (0.40) —
SCHEMBL21315518 0.69 DUT (0.66) DUT
SCHEMBL12630551 0.69 DUT (0.66) DUT
SCHEMBL12711111 0.68 DUT (0.47) DUTFFAR1
SCHEMBL12696960 0.67 DUT (0.69) DUT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8530490-B2 Uracil compound or salt thereof having human deoxyuridine triphosphatase inhibitory activity TAIHO PHARMACEUTICAL CO., LTD. (JP) 2013-09-10 — — US disclosed
US-20110082163-A1 NOVEL URACIL COMPOUND OR SALT THEREOF HAVING HUMAN DEOXYURIDINE TRIPHOSPHATASE INHIBITORY ACTIVITY TAIHO PHARMACEUTICAL CO., LTD. (JP) 2011-04-07 — — 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 (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-20110082163-A1 NOVEL URACIL COMPOUND OR SALT THEREOF HAVING HUMAN DEOXYURIDINE TRIPHOSPHATASE INHIBITORY ACTIVITY SNRPB2, SNRPA1, DUT TP53 1714/4885DUT 3/4885GAA 1552/4885

“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.

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