SCHEMBL9250895

SCHEMBL9250895

CCC(Nc1nc(NCCCN(CCN(CCCNc2nc(NC(CC)OCC3CC(C)(C)N(C)C(C)(C)C3)nc(NC(CC)OCC3CC(C)(C)N(C)C(C)(C)C3)n2)c2nc(NC(CC)OCC3CC(C)(C)N(C)C(C)(C)C3)nc(NC(CC)OCC3CC(C)(C)N(C)C(C)(C)C3)n2)c2nc(NC(CC)OCC3CC(C)(C)N(C)C(C)(C)C3)nc(NC(CC)OCC3CC(C)(C)N(C)C(C)(C)C3)n2)nc(NC(CC)OCC2CC(C)(C)N(C)C(C)(C)C2)n1)OCC1CC(C)(C)N(C)C(C)(C)C1

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL8870643 0.94 SMN1; SMN2 (0.31) SMN1; SMN2
SCHEMBL9250960 0.87
SCHEMBL4280278 0.79 SMN1; SMN2 (0.33) SMN1; SMN2
SCHEMBL4280274 0.77 SMN1; SMN2 (0.34) SMN1; SMN2
SCHEMBL11331854 0.75 SMN1; SMN2 (0.38) SMN1; SMN2
SCHEMBL4450565 0.74 SMN1; SMN2 (0.31) SMN1; SMN2
SCHEMBL8789783 0.73 SMN1; SMN2 (0.30) SMN1; SMN2
SCHEMBL4049676 0.73 SMN1; SMN2 (0.31) SMN1; SMN2
SCHEMBL20434887 0.73 SMN1; SMN2 (0.33) SMN1; SMN2
SCHEMBL39027 0.72 SMN1; SMN2 (0.35) SMN1; SMN2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5384346-A LAMINATE OF SILICATE GLASS SHEETS AND PLASTICIZED POLYVINYL BUTYRAL INTERLAYER FILMS HOECHST AG (DE) 1995-01-24 US disclosed
US-5356967-A Raeacting formed Grignard reagent with a chloro-dibenzooxa-phosphorine derivative HOECHST AKTIENGESELLSCHAFT (DE) 1994-10-18 US disclosed
US-5298541-A Molding materials HOECHST AKTIENGESELLSCHAFT (DE) 1994-03-29 US disclosed