SCHEMBL14922192

SCHEMBL14922192

CCCCNC(=O)c1nc(-c2ccnn2-c2ccc(C#N)cc2)c(C)n(-c2cccc(C(F)(F)F)c2)c1=O

nearest known ligand 0.61

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ELANE P08246 16/20 0.61
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
CASP6 P55212 1/20 0.39
CTSK P43235 2/20 0.39
CYP3A4 P08684 1/20 0.38
CYP2C9 P11712 2/20 0.37

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
SCHEMBL524078 0.93 ELANE (0.64) ELANEMEN1KMT2ACTSKCYP3A4
SCHEMBL1603366 0.92 ELANE (0.59) ELANEMEN1KMT2ACTSK
SCHEMBL1604022 0.92 ELANE (0.61) ELANEMEN1KMT2ACYP2C9
Iodide SCHEMBL1603408 0.92 ELANE (0.60) ELANEMEN1KMT2ACYP2C9
SCHEMBL597096 0.91 ELANE (0.61) ELANEMEN1KMT2ACYP3A4CYP2C9
SCHEMBL597440 0.91 ELANE (0.63) ELANEMEN1KMT2ACYP3A4CYP2C9
Acetic Acid SCHEMBL1603082 0.90 ELANE (0.58) ELANEMEN1KMT2ACYP3A4CYP2C9
SCHEMBL525061 0.89 ELANE (0.74) ELANEMEN1KMT2ACTSKCYP3A4
SCHEMBL595623 0.88 ELANE (0.60) ELANEMEN1KMT2ACYP3A4CYP2C9
SCHEMBL597381 0.87 ELANE (0.62) ELANEMEN1KMT2ACYP3A4CYP2C9

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-8436024-B2 2-pyridone compounds ASTRAZENECA AB (GB) 2013-05-07 US disclosed