SCHEMBL13833428

SCHEMBL13833428

NC(=O)c1coc2nc(N)nc(N)c12

nearest known ligand 0.41

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ DHFR P00374 7/20 0.41
▸ KDR P35968 4/20 0.41
▸ PDGFRB P09619 2/20 0.40

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
SCHEMBL13833434 0.72 TYMS (0.36) —
SCHEMBL13833594 0.71 DHFR (0.47) DHFRKDR
SCHEMBL19417781 0.70 DHFR (0.40) DHFRKDRPDGFRB
SCHEMBL13833595 0.70 DHFR (0.46) DHFRKDR
SCHEMBL13833442 0.67 DHFR (0.36) DHFRKDRPDGFRB
SCHEMBL2915133 0.67 DHFR (0.46) DHFRKDR
SCHEMBL13833608 0.66 CHUK (0.43) —
SCHEMBL4870674 0.64 DHFR (0.43) DHFRKDRPDGFRB
SCHEMBL354546 0.63 PARP1 (0.41) —
SCHEMBL2385337 0.62 P2RX3 (0.43) —

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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