SCHEMBL19905048

SCHEMBL19905048

CNC(=O)c1c(F)cnc2c(C(C)[C@H](C)CNc3cc(-c4ccc(C(C)C)nc4)ncn3)cccc12

nearest known ligand 0.39

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PRKDC P78527 2/20 0.39
FAAH O00519 18/20 0.38

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
SCHEMBL15339668 0.92 PRKDC (0.46) PRKDCFAAH
SCHEMBL20373310 0.92 PRKDC (0.42) PRKDCFAAH
SCHEMBL19905199 0.89 PRKDC (0.38) PRKDCFAAH
SCHEMBL19905352 0.89 PRKDC (0.41) PRKDCFAAH
SCHEMBL19905485 0.89 PRKDC (0.42) PRKDCFAAH
SCHEMBL19905459 0.88 PRKDC (0.42) PRKDCFAAH
SCHEMBL19905097 0.88 PRKDC (0.38) PRKDCFAAH
SCHEMBL19355308 0.87 PRKDC (0.37) PRKDCFAAH
SCHEMBL19905192 0.86 PRKDC (0.39) PRKDCFAAH
SCHEMBL22838703 0.86 PRKDC (0.37) PRKDCFAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3057959-B1 DNA-PK INHIBITORS VERTEX PHARMA (US) 2018-02-28 EP disclosed