Sugi Predict

Sugi Predict / Compounds / SCHEMBL4450565

SCHEMBL4450565

SCHEMBL4450565

CCC(OC)N(c1nc(NCCCN(CCN(CCCNc2nc(N(C3CC(C)(C)N(C)C(C)(C)C3)C(CC)OC)nc(N(C3CC(C)(C)N(C)C(C)(C)C3)C(CC)OC)n2)c2nc(N(C3CC(C)(C)N(C)C(C)(C)C3)C(CC)OC)nc(N(C3CC(C)(C)N(C)C(C)(C)C3)C(CC)OC)n2)c2nc(N(C3CC(C)(C)N(C)C(C)(C)C3)C(CC)OC)nc(N(C3CC(C)(C)N(C)C(C)(C)C3)C(CC)OC)n2)nc(N(C2CC(C)(C)N(C)C(C)(C)C2)C(CC)OC)n1)C1CC(C)(C)N(C)C(C)(C)C1

nearest known ligand 0.31

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ FLT3 P36888 1/20 0.30
▸ TYRO3 Q06418 1/20 0.30
▸ MERTK Q12866 1/20 0.30
▸ GAS6 Q14393 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
SCHEMBL4446866 0.87 — —
SCHEMBL20434887 0.80 SMN1; SMN2 (0.33) SMN1; SMN2FLT3TYRO3MERTKGAS6
SCHEMBL39027 0.79 SMN1; SMN2 (0.35) SMN1; SMN2FLT3TYRO3MERTKGAS6
SCHEMBL9917170 0.76 SMN1; SMN2 (0.39) SMN1; SMN2FLT3TYRO3MERTKGAS6
SCHEMBL6927282 0.75 SMN1; SMN2 (0.33) SMN1; SMN2FLT3TYRO3MERTKGAS6
SCHEMBL8789990 0.74 SMN1; SMN2 (0.31) SMN1; SMN2
SCHEMBL9250895 0.74 SMN1; SMN2 (0.32) SMN1; SMN2
SCHEMBL9917154 0.73 CRHR1 (0.34) SMN1; SMN2FLT3TYRO3MERTKGAS6
SCHEMBL4280278 0.73 SMN1; SMN2 (0.33) SMN1; SMN2FLT3TYRO3MERTKGAS6
SCHEMBL13531438 0.73 — —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2028227-A1 Flame-resistant plastic moulding material CLARIANT INTERNATIONAL LTD. (CH) 2009-02-25 — — EP disclosed
US-6013706-A Process for the preparation of hyrolysis-stable trivalent phosphorus compounds and their use as stabilizers for thermoplastics CLARIANT GMBH (DE) 2000-01-11 — — US disclosed
EP-0668283-B1 Process for the preparation of polyalkyl-1-oxadiazaspirodecane compounds CLARIANT GMBH (DE) 1998-05-20 — — EP disclosed
EP-0584567-B1 Fire retardant polymer compositions with increased stability CLARIANT GMBH (DE) 1998-01-28 — — EP disclosed
EP-0524640-B1 Diarylphosphinous acid arylesters, process for their preparation and their use to stabilize polymers, in particular polyolefin moulding compositions HOECHST AG (DE) 1997-01-29 — — EP disclosed
EP-0472564-B1 ARYLESTERS OF PHOSPHONOUS ACID, PROCESS FOR PREPARING THEM AND THEIR USE TO STABILIZE PLASTICS, IN PARTICULAR POLYOLEFIN MOULDING MATERIALS HOECHST AG (DE) 1994-09-21 — — EP disclosed
EP-0599284-A1 Cyclo-olefin polymer moulding composition with improved stability against chemical degradation HOECHST AKTIENGESELLSCHAFT (DE) 1994-06-01 — — EP disclosed
EP-0576833-A2 Process for preparing hydrolytically stable trivalent phosphorus compounds and their use as stabilisators for thermoplastic materials HOECHST AKTIENGESELLSCHAFT (DE) 1994-01-05 — — EP disclosed
EP-0524640-A1 Diarylphosphinous acid arylesters, process for their preparation and their use to stabilize polymers, in particular polyolefin moulding compositions HOECHST AKTIENGESELLSCHAFT (DE) 1993-01-27 — — EP disclosed
WO-1991002738-A1 ARYL ESTER AMIDE HALIDES OF PHOSPHONOUS ACID, ARYL ESTER AMIDES OF PHOSPHONOUS ACID, PROCESS FOR PREPARING THEM AND THEIR USE TO STABILIZE PLASTICS HOECHST AKTIENGESELLSCHAFT (DE) 1991-03-07 — — WO disclosed
WO-1990014349-A2 ARYLESTERS OF PHOSPHONOUS ACID, PROCESS FOR PREPARING THEM AND THEIR USE TO STABILIZE PLASTICS, IN PARTICULAR POLYOLEFIN MOULDING MATERIALS HOECHST AKTIENGESELLSCHAFT (DE) 1990-11-29 — — WO disclosed