SCHEMBL12630549

SCHEMBL12630549

CC[C@@H](NS(=O)(=O)CCCO)c1cccc(OCC2CC2)c1

nearest known ligand 0.67

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ DUT P33316 20/20 0.67

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
SCHEMBL21690431 0.90 DUT (0.69) DUT
SCHEMBL12630548 0.89 DUT (0.66) DUT
SCHEMBL20361933 0.89 DUT (0.66) DUT
SCHEMBL21690378 0.88 DUT (0.65) DUT
SCHEMBL12630525 0.86 DUT (0.68) DUT
SCHEMBL21690674 0.86 DUT (0.68) DUT
SCHEMBL12630534 0.85 DUT (0.67) DUT
SCHEMBL12696867 0.85 DUT (0.67) DUT
SCHEMBL21690319 0.85 DUT (0.67) DUT
SCHEMBL20188134 0.84 DUT (0.61) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2295414-B1 URACIL COMPOUND HAVING INHIBITORY ACTIVITY ON HUMAN DEOXYURIDINE TRIPHOSPHATASE OR SALT THEREOF TAIHO PHARMACEUTICAL CO LTD (JP) 2012-09-26 — — EP disclosed
WO-2011065545-A1 5-FLUOROURACIL COMPOUND HAVING dUTPase-INHIBITING ACTIVITY OR SALT THEREOF 大鵬薬品工業株式会社 (JP) 2011-06-03 — — WO disclosed
EP-2295414-A1 NOVEL URACIL COMPOUND HAVING INHIBITORY ACTIVITY ON HUMAN DEOXYURIDINE TRIPHOSPHATASE OR SALT THEREOF Taiho Pharmaceutical Co., Ltd. (JP) 2011-03-16 — — EP disclosed
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