SCHEMBL6571691

SCHEMBL6571691

NCCNCn1cc(Br)c(=O)[nH]c1=O

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GRIA1 P42261 1/20 0.48
GRIA2 P42262 1/20 0.48
GRIA4 P48058 1/20 0.48
GRIK5 Q16478 1/20 0.48
TDP1 Q9NUW8 1/20 0.46
KMT2A Q03164 2/20 0.45
MEN1 O00255 1/20 0.45
DTYMK P23919 1/20 0.43
CYP1A2 P05177 1/20 0.42
CYP2C19 P33261 1/20 0.42
ALDH1A1 P00352 1/20 0.42
ASAH1 Q13510 1/20 0.40
GAA P10253 1/20 0.38
SQOR Q9Y6N5 1/20 0.37
LMNA P02545 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
SCHEMBL6571664 0.81 GRIA1 (0.48) GRIA1GRIA2GRIA4GRIK5
SCHEMBL6571672 0.81 KMT2A (0.48) GRIA1GRIA2GRIA4GRIK5KMT2A
SCHEMBL13992284 0.71 GRIA1 (0.53) GRIA1GRIA2GRIA4GRIK5TDP1
SCHEMBL7181578 0.68 CYP1A2 (0.60) GRIA1GRIA2GRIA4GRIK5TDP1
SCHEMBL1717207 0.68 MEN1 (0.78) GRIA1GRIA2GRIA4GRIK5KMT2A
SCHEMBL125267 0.68 MEN1 (0.53) GRIA1GRIA2GRIA4GRIK5TDP1
SCHEMBL12499652 0.68 MEN1 (0.57) GRIA1GRIA2GRIA4GRIK5TDP1
SCHEMBL5117415 0.68 GRIA1 (0.54) GRIA1GRIA2GRIA4GRIK5TDP1
SCHEMBL2153060 0.67 GRIA1 (0.60) GRIA1GRIA2GRIA4GRIK5TDP1
SCHEMBL4564516 0.67 GRIA1 (0.49) GRIA1GRIA2GRIA4GRIK5TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0884051-B1 CANCEROUS METASTASIS INHIBITORS CONTAINING URACIL DERIVATIVES TAIHO PHARMACEUTICAL CO LTD (JP) 2004-12-15 EP disclosed
EP-0763529-B1 URACIL DERIVATIVES, AND ANTITUMOR EFFECT POTENTIATOR AND ANTITUMOR AGENT CONTAINING THE SAME TAIHO PHARMACEUTICAL CO LTD (JP) 2003-07-23 EP disclosed
US-6294535-B1 TREATING CANCER, WHICH COMPRISES ADMINISTERING TO A PATIENT IN NEED OF TREATMENT AN EFFECTIVE AMOUNT OF A URACIL DERIVATIVE TAIHO PHARMACEUTICAL CO., LTD. (JP) 2001-09-25 US disclosed
US-6255314-B1 Cancerous metastasis inhibitors containing uracil derivatives TAIHO CHARMACEUTICAL CO., LTD. (JP) 2001-07-03 US disclosed
US-6159969-A Uracil derivatives, and antitumor effect potentiator and antitumor agent containing the same TAIHO PHARMACEUTICAL CO., LTD. (JP) 2000-12-12 US disclosed
EP-0884051-A1 CANCEROUS METASTASIS INHIBITORS CONTAINING URACIL DERIVATIVES TAIHO PHARMACEUTICAL COMPANY LIMITED (JP) 1998-12-16 EP disclosed
US-5744475-A 4-N-HET-METHYLURACIL DERIVATIVES; THYMIDINE PHOSPHORYLASE INHIBITORS TAIHO PHARMACEUTICAL CO., LTD. (JP) 1998-04-28 US disclosed
EP-0763529-A1 URACIL DERIVATIVES, AND ANTITUMOR EFFECT POTENTIATOR AND ANTITUMOR AGENT CONTAINING THE SAME TAIHO PHARMACEUTICAL COMPANY LIMITED (JP) 1997-03-19 EP disclosed