SCHEMBL9099269

SCHEMBL9099269

N#Cc1c[c]nc(OC(=O)c2cccs2)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MIF P14174 1/20 0.43
KMT2A Q03164 14/20 0.42
MAPT P10636 7/20 0.42
MEN1 O00255 4/20 0.42
ALDH1A1 P00352 4/20 0.41
CTSB P07858 3/20 0.40
HPGD P15428 3/20 0.40
ALOX15 P16050 2/20 0.40
HSD17B10 Q99714 2/20 0.40
KDM4E B2RXH2 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.38
POLB P06746 1/20 0.38
SAE1 Q9UBE0 1/20 0.38
UBA2 Q9UBT2 1/20 0.38
PLA2G1B P04054 2/20 0.38
ATG4B Q9Y4P1 2/20 0.38
TDP1 Q9NUW8 1/20 0.38
LMNA P02545 1/20 0.37

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
SCHEMBL9480780 0.79 KMT2A (0.40) KMT2AMAPTMEN1ALDH1A1HPGD
SCHEMBL9098734 0.74 MIF (0.48) MIFKMT2AMAPTMEN1ALDH1A1
SCHEMBL9668931 0.69 MIF (0.48) MIFKMT2AMAPTMEN1ALDH1A1
SCHEMBL7071573 0.68 KMT2A (0.54) KMT2AMAPTMEN1ALDH1A1HPGD
Isonicotinonitrile SCHEMBL28220615 0.67 KMT2A (0.49) KMT2AMAPTMEN1ALDH1A1HPGD
SCHEMBL9098931 0.66 KMT2A (0.46) MIFKMT2AMAPTMEN1ALDH1A1
SCHEMBL3268211 0.66 CES2 (0.62) MIFKMT2AMAPTMEN1ALDH1A1
SCHEMBL31337905 0.65 MIF (0.56) MIFKMT2AMAPTMEN1ALDH1A1
SCHEMBL9480201 0.65 RECQL (0.36)
SCHEMBL31689109 0.65 CES2 (0.52) KMT2AMAPTMEN1ALDH1A1HPGD

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-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-0180897-B1 5-FLUOROURACIL DERIVATIVES OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1991-08-07 EP 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-0180897-A2 5-Fluorouracil derivatives OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1986-05-14 EP disclosed