SCHEMBL8044210

SCHEMBL8044210

CN1CCc2cc(-n3cc(CNC(=O)c4ccc(Cl)s4)nn3)ccc2C1

nearest known ligand 0.51

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MIF P14174 2/20 0.51
NOTUM Q6P988 1/20 0.47
F10 P00742 17/20 0.46

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
SCHEMBL3093673 0.81 MIF (0.54) MIFNOTUMF10
SCHEMBL3087805 0.80 MIF (0.55) MIFNOTUMF10
SCHEMBL1097349 0.79 MIF (0.52) MIFNOTUMF10
SCHEMBL3091423 0.78 MIF (0.62) MIFNOTUMF10
SCHEMBL1106557 0.77 MIF (0.61) MIFNOTUM
SCHEMBL1095716 0.77 F10 (0.56) MIFF10
SCHEMBL8049656 0.76 LMNA (0.44) F10
SCHEMBL1096549 0.76 MIF (0.48) MIFNOTUMF10
SCHEMBL3090082 0.76 MIF (0.60) MIFNOTUM
SCHEMBL3082953 0.76 MIF (0.59) MIFNOTUMF10

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-2009063029-A2 SUBSTITUTED AMIDES, MANUFACTURING AND USE THEREOF AS MEDICAMENTS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-05-22 WO disclosed