SCHEMBL19251262

SCHEMBL19251262

CCCCCC(C)(C)c1cnc(C)nc1

nearest known ligand 0.46

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 18/20 0.46
CNR1 P21554 15/20 0.43

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
SCHEMBL19251082 0.98 CNR2 (0.49) CNR2CNR1
SCHEMBL19251045 0.98 CNR2 (0.49) CNR2CNR1
SCHEMBL21789887 0.94 CNR2 (0.40) CNR2CNR1
SCHEMBL18744472 0.86 CNR2 (0.33) CNR2CNR1
SCHEMBL22752261 0.83 CNR2 (0.38) CNR2CNR1
SCHEMBL19251047 0.83 CNR2 (0.38) CNR2CNR1
SCHEMBL19251539 0.83 CNR2 (0.38) CNR2CNR1
SCHEMBL22674620 0.81 CNR2 (0.37) CNR2CNR1
SCHEMBL22663616 0.81 CNR2 (0.44) CNR2CNR1
SCHEMBL18935497 0.81 CNR2 (0.44) CNR2CNR1

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
US-9732083-B2 Tricyclic gyrase inhibitors MERCK SHARP & DOHME CORP. (US) 2017-08-15 US disclosed