SCHEMBL13833595

SCHEMBL13833595

Nc1nc(N)c2c(CO)coc2n1

nearest known ligand 0.53

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ DHFR P00374 1/20 0.46
▸ EGFR P00533 1/20 0.46
▸ KDR P35968 1/20 0.46

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
SCHEMBL13833594 0.84 DHFR (0.47) DHFREGFRKDR
SCHEMBL2915133 0.82 DHFR (0.46) DHFREGFRKDR
SCHEMBL5861834 0.74 DHFR (0.46) DHFREGFRKDR
SCHEMBL5861670 0.72 — —
SCHEMBL6310645 0.72 DHFR (0.47) DHFREGFRKDR
SCHEMBL6311077 0.72 MBOAT4 (0.78) DHFR
SCHEMBL4871146 0.71 DHFR (0.47) DHFREGFRKDR
SCHEMBL19417781 0.71 DHFR (0.40) DHFREGFRKDR
SCHEMBL13833428 0.70 DHFR (0.41) DHFRKDR
SCHEMBL6304456 0.70 — —

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-2707487-B1 RIBOSWITCHES UNIV MANCHESTER (GB) 2017-10-04 — — EP disclosed
US-20140213779-A1 RIBOSWITCHES THE UNIVERSITY OF MANCHESTER (GB) 2014-07-31 — — US disclosed
US-20140213779-A1 RIBOSWITCHES THE UNIVERSITY OF MANCHESTER (GB) 2014-07-31 — — US disclosed
WO-2012153142-A2 RIBOSWITCHES THE UNIVERSITY OF MANCHESTER (GB) 2012-11-15 — — WO disclosed
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