SCHEMBL17739677

SCHEMBL17739677

CNc1cc(Cl)cc(N2CCNC(C)(C)C2)c1CN

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
LATS1 O95835 1/20 0.34
HDAC1 Q13547 1/20 0.32
DDR1 Q08345 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
SCHEMBL17738234 0.80 LATS1 (0.34) LATS1DDR1
SCHEMBL17739379 0.76 PIK3CD (0.37)
SCHEMBL5569781 0.72 NR1H4 (0.41) LATS1HDAC1DDR1
SCHEMBL17739040 0.69 HDAC1 (0.40) LATS1HDAC1
SCHEMBL17738256 0.69 LATS1 (0.35) LATS1HDAC1
SCHEMBL17739338 0.69 LATS1 (0.33) LATS1HDAC1
SCHEMBL31687242 0.67 IDO1 (0.44) LATS1
SCHEMBL17731749 0.67 IDO1 (0.44) LATS1
SCHEMBL18378793 0.66 IDO1 (0.54) LATS1HDAC1
SCHEMBL17739047 0.65 LATS1 (0.34) LATS1HDAC1

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-2016071293-A2 PHARMACEUTICAL COMPOUND IOMET PHARMA LTD (GB) 2016-05-12 WO disclosed