SCHEMBL9098367

SCHEMBL9098367

CCCCCOC(=O)CCN[C]=O

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.52
DGKA P23743 1/20 0.52
HTR2C P28335 1/20 0.50
FAAH O00519 1/20 0.47
PRSS1 P07477 1/20 0.45
PRSS2 P07478 1/20 0.45
PRSS3 P35030 1/20 0.45
EPHX2 P34913 3/20 0.45
RAD52 P43351 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
LMNA P02545 1/20 0.45
EPHX1 P07099 1/20 0.44
DNM1 Q05193 1/20 0.44
ACHE P22303 6/20 0.43

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
SCHEMBL9693869 0.98 NAAA (0.55) NAAADGKAHTR2CFAAHPRSS1
SCHEMBL7488981 0.89 DGKA (0.61) NAAADGKAHTR2CFAAHPRSS1
SCHEMBL8657069 0.85 NAAA (0.50) NAAADGKAHTR2CFAAHPRSS1
SCHEMBL6006524 0.83 DGKA (0.58) NAAADGKAHTR2CFAAHPRSS1
Hydrochloric Acid SCHEMBL7450352 0.83 NAAA (0.49) NAAADGKAHTR2CFAAHPRSS1
SCHEMBL7672090 0.82 NAAA (0.55) NAAADGKAHTR2CFAAHRAD52
SCHEMBL5982045 0.81 NAAA (0.58) NAAADGKAHTR2CFAAHRAD52
SCHEMBL7004130 0.81 NAAA (0.58) NAAADGKAHTR2CFAAHRAD52
SCHEMBL1864792 0.81 NAAA (0.58) NAAADGKAHTR2CFAAHRAD52
SCHEMBL591366 0.80 NAAA (0.57) NAAADGKAHTR2CFAAHPRSS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0323441-B1 5-Fluorouracil derivatives OTSUKA PHARMA CO LTD (JP) 1996-04-24 EP disclosed
EP-0436902-B1 5-Fluorouracil derivatives OTSUKA PHARMA CO LTD (JP) 1995-06-28 EP disclosed
EP-0247381-B1 5-FLUROROURACIL DERIVATIVES OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1993-08-04 EP disclosed
US-5155113-A Administering 5-fluorouracil and derivatives with pyridine and pyridone derivatives OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1992-10-13 US disclosed
US-5047521-A Anticarcinogenic agents OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1991-09-10 US disclosed
EP-0436902-A1 5-Fluorouracil derivatives OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1991-07-17 EP disclosed
US-4983609-A Anticancer agents OTSUKA PHARMACEUTICAL (JP) 1991-01-08 US disclosed
US-4864021-A ANTICARCINOGENIC AGENTS, ANTITUMOR AGENTS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1989-09-05 US disclosed
EP-0323441-A2 5-Fluorouracil derivatives OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1989-07-05 EP disclosed
EP-0247381-A2 5-flurorouracil derivatives OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1987-12-02 EP disclosed
EP-0180897-A2 5-Fluorouracil derivatives OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1986-05-14 EP disclosed
EP-0180188-A2 A composition for increasing the anti-cancer activity of an anti-cancer compound OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1986-05-07 EP disclosed