SCHEMBL17208720

SCHEMBL17208720

CCN1CCN(Cc2ccc(C(=O)Nc3ccc(C)c(NCc4cnc(NC(=O)OC)cn4)c3)cc2C(F)(F)F)CC1

nearest known ligand 0.95

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ RAD52 P43351 1/20 0.95
▸ DDR1 Q08345 1/20 0.66
▸ NR2C2 P49116 2/20 0.57
▸ BTK Q06187 2/20 0.57
▸ HTT P42858 2/20 0.57
▸ MAPK1 P28482 1/20 0.57
▸ ATM Q13315 1/20 0.57

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
SCHEMBL2228555 0.94 RAD52 (0.84) RAD52DDR1NR2C2BTKHTT
SCHEMBL2226738 0.93 RAD52 (0.82) RAD52DDR1NR2C2BTKHTT
SCHEMBL19986849 0.92 RAD52 (0.81) RAD52DDR1NR2C2BTKHTT
SCHEMBL17208696 0.92 RAD52 (0.80) RAD52DDR1NR2C2BTKHTT
SCHEMBL17208642 0.91 RAD52 (0.79) RAD52DDR1NR2C2BTKHTT
SCHEMBL22457642 0.90 RAD52 (0.78) RAD52DDR1NR2C2BTKHTT
SCHEMBL2280193 0.88 RAD52 (0.75) RAD52DDR1NR2C2BTKHTT
SCHEMBL17208738 0.85 RAD52 (0.71) RAD52DDR1NR2C2BTKHTT
SCHEMBL19986863 0.85 RAD52 (0.71) RAD52DDR1NR2C2
SCHEMBL16588513 0.85 RAD52 (0.71) RAD52DDR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2937345-B1 TYPE II RAF KINASE INHIBITORS DANA FARBER CANCER INST INC (US) 2018-03-21 — — EP disclosed
EP-2937345-A2 Type II raf kinase inhibitors Dana-Farber Cancer Institute, Inc. (US) 2015-10-28 — — EP disclosed
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