SCHEMBL9101158

SCHEMBL9101158

CCOC(=O)Oc1cc(O)c(Cl)cn1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CUL4A Q13619 2/20 0.40
JAK2 O60674 1/20 0.40
JAK1 P23458 1/20 0.40
TYK2 P29597 1/20 0.40
JAK3 P52333 1/20 0.40
ALDH1A1 P00352 4/20 0.39
NPSR1 Q6W5P4 2/20 0.39
MAPT P10636 2/20 0.39
NPC1 O15118 1/20 0.39
TP53 P04637 1/20 0.39
XBP1 P17861 1/20 0.39
MAPK1 P28482 1/20 0.39
HTT P42858 1/20 0.39
HSD17B10 Q99714 1/20 0.39
TLR9 Q9NR96 1/20 0.39
NR1H2 P55055 1/20 0.36
NR1H3 Q13133 1/20 0.36
BAZ2B Q9UIF8 1/20 0.35
BAZ2A Q9UIF9 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35

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
SCHEMBL9098843 0.79 KDM4E (0.36) ALDH1A1MAPTTP53HTTHSD17B10
SCHEMBL11641291 0.79 MAPT (0.40) ALDH1A1NPSR1MAPTNPC1TP53
SCHEMBL2918657 0.76 JAK2 (0.39) CUL4AJAK2JAK1TYK2JAK3
SCHEMBL9099453 0.73 JAK2 (0.35) CUL4AJAK2JAK1TYK2JAK3
SCHEMBL9319741 0.73 ALDH1A1 (0.38) CUL4AJAK2JAK1TYK2JAK3
SCHEMBL9318582 0.72 DRD1 (0.37) CUL4AJAK2JAK1TYK2JAK3
SCHEMBL10717364 0.71 KDM4E (0.54) ALDH1A1MAPTNPC1HSD17B10KDM4E
SCHEMBL172301 0.71 NNMT (0.41) MAPTHSD17B10KDM4EHPGDMEN1
SCHEMBL3997981 0.71 CUL4A (0.48) CUL4AJAK2JAK1TYK2JAK3
SCHEMBL10435485 0.71 L3MBTL1 (0.46) CUL4AALDH1A1NPSR1MAPTNPC1

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 7 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
US-5155113-A Administering 5-fluorouracil and derivatives with pyridine and pyridone derivatives OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1992-10-13 US disclosed
EP-0180188-B1 A COMPOSITION FOR INCREASING THE ANTI-CANCER ACTIVITY OF AN ANTI-CANCER COMPOUND OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1992-04-15 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-0180897-A2 5-Fluorouracil derivatives OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1986-05-14 EP disclosed