SCHEMBL18618877

SCHEMBL18618877

Nc1cc(Cc2ccc(F)c(F)c2)c2c(n1)NNN2

nearest known ligand 0.55

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ MPO P05164 18/20 0.55

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
SCHEMBL18620324 0.86 MPO (0.53) MPO
SCHEMBL18620321 0.82 MPO (0.56) MPO
SCHEMBL18621228 0.81 MPO (0.55) MPO
SCHEMBL18618928 0.81 MPO (0.55) MPO
SCHEMBL18618819 0.80 MPO (0.51) MPO
SCHEMBL18620054 0.78 MPO (0.60) MPO
SCHEMBL18618875 0.78 MPO (0.55) MPO
SCHEMBL18620305 0.78 MPO (0.55) MPO
SCHEMBL18618929 0.78 MPO (0.55) MPO
SCHEMBL18620093 0.77 MPO (0.56) MPO

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
WO-2017040451-A1 TRIAZOLOPYRIDINE INHIBITORS OF MYELOPEROXIDASE BRISTOL-MYERS SQUIBB COMPANY (US) 2017-03-09 — — WO disclosed
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