SCHEMBL8943510

SCHEMBL8943510

CCOC(C)(C)C(Oc1nc(OC)nc(OC)n1)C(=O)OCc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
EDNRB P24530 14/20 0.47
EDNRA P25101 14/20 0.47
L3MBTL1 Q9Y468 2/20 0.39
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.37
KMT2A Q03164 1/20 0.36

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
SCHEMBL9367453 0.87 EDNRB (0.44) EDNRBEDNRAL3MBTL1ALDH1A1KMT2A
SCHEMBL8943534 0.84 EDNRB (0.41) EDNRBEDNRAALDH1A1KMT2A
SCHEMBL9702494 0.76 L3MBTL1 (0.37) EDNRBEDNRAL3MBTL1ALDH1A1LMNA
SCHEMBL9756283 0.72 L3MBTL1 (0.44) L3MBTL1ALDH1A1LMNAKMT2A
SCHEMBL6712034 0.70 EDNRB (0.61) EDNRBEDNRA
SCHEMBL3714105 0.69 EDNRB (0.72) EDNRBEDNRAKMT2A
SCHEMBL3714106 0.69 EDNRB (0.72) EDNRBEDNRAKMT2A
SCHEMBL8118735 0.68 EDNRB (0.56) EDNRBEDNRAKMT2A
SCHEMBL6946124 0.67 ALDH1A1 (0.62) L3MBTL1ALDH1A1LMNAKMT2A
SCHEMBL9723448 0.67 ALDH1A1 (0.48) EDNRBEDNRAALDH1A1LMNAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0517215-A1 Pyrimidine or triazine derivative, process for preparing the same and herbicide using the same UBE INDUSTRIES, LTD. (JP) 1992-12-09 EP claimed
US-5529977-A A 3-ALKOXYBUTYRYLIMIDAZOLE COMPOUND UBE INDUSTRIES, LTD. (JP) 1996-06-25 US disclosed
US-5387575-A Pyrimidine derivatives, process for preparing the same and herbicide using the same UBE INDUSTRIES, LTD. (JP) 1995-02-07 US disclosed
EP-0517215-A1 Pyrimidine or triazine derivative, process for preparing the same and herbicide using the same UBE INDUSTRIES, LTD. (JP) 1992-12-09 EP disclosed