SCHEMBL16442182

SCHEMBL16442182

CCC(NC)C1CCN(C)C1

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NCF1 P14598 1/20 0.34
SHBG P04278 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL14432000 0.80
SCHEMBL10238598 0.78 SMN1; SMN2 (0.32) SHBG
SCHEMBL10188211 0.76
SCHEMBL11915409 0.75
SCHEMBL27663102 0.75
SCHEMBL13576372 0.75 NCF1 (0.32) NCF1
SCHEMBL13713091 0.75 NCF1 (0.32) NCF1
SCHEMBL21452801 0.73 NCF1 (0.31) NCF1KMT2A
SCHEMBL1870619 0.73 SHBG (0.50) SHBG
SCHEMBL170904 0.73 SHBG (0.50) SHBG

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-8946422-B2 8-methoxy-9H-isothiazolo[5,4-B]quinoline-3,4-diones and related compounds as anti-infective agents ACHILLION PHARMACEUTICALS, INC. (US) 2015-02-03 US disclosed