SCHEMBL12898153

SCHEMBL12898153

Fc1cccc(CNc2nc(-c3cc(NC4CCCCC4)ncc3Cl)ccc2F)c1

nearest known ligand 0.79

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CCNT1 O60563 20/20 0.79

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
SCHEMBL1192032 0.91 CCNT1 (0.86) CCNT1
SCHEMBL12898167 0.91 CCNT1 (0.86) CCNT1
SCHEMBL12849930 0.88 CCNT1 (1.00) CCNT1
SCHEMBL12849932 0.87 CCNT1 (1.00) CCNT1
SCHEMBL12898126 0.85 CCNT1 (0.84) CCNT1
SCHEMBL12849799 0.83 CCNT1 (1.00) CCNT1
SCHEMBL12889520 0.83 CCNT1 (0.83) CCNT1
SCHEMBL8785991 0.83 CCNT1 (0.74) CCNT1
SCHEMBL1192389 0.82 CCNT1 (0.58) CCNT1
SCHEMBL12898599 0.81 CCNT1 (0.88) CCNT1

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-2011012661-A1 PYRIDINE AND PYRAZINE DERIVATIVES AS PROTEIN KINASE MODULATORS NOVARTIS AG (CH) 2011-02-03 WO disclosed