SCHEMBL16975263

SCHEMBL16975263

CCNC(=O)Nc1nc2cc(-c3cnc(NS(=O)(=O)N4CC[C@@H](N(C)C)C4)nc3)cc(-c3ccc(C)cn3)c2s1

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ PIK3CD O00329 1/20 0.34
▸ PIK3CB P42338 1/20 0.34
▸ PIK3CG P48736 1/20 0.34
▸ ABL1 P00519 1/20 0.33

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
SCHEMBL16975354 0.91 ABL1 (0.34) SMN1; SMN2ABL1
SCHEMBL16975235 0.91 ABL1 (0.34) SMN1; SMN2ABL1
SCHEMBL16975244 0.91 ABL1 (0.34) SMN1; SMN2ABL1
SCHEMBL16975269 0.88 PIK3C3 (0.37) SMN1; SMN2ABL1
SCHEMBL16975210 0.87 AXL (0.36) —
SCHEMBL16975312 0.86 ABL1 (0.37) ABL1
SCHEMBL16975224 0.86 MAPT (0.39) ABL1
SCHEMBL16975217 0.84 NPC1 (0.38) SMN1; SMN2ABL1
SCHEMBL16975195 0.83 PIK3CD (0.35) LMNASMN1; SMN2PIK3CDPIK3CG
SCHEMBL16975206 0.83 PIK3CD (0.35) LMNASMN1; SMN2PIK3CDPIK3CG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3102203-A2 ANTIBACTERIAL COMBINATIONS COMPRISING POLYMYXIN SPERO GYRASE, INC. (US) 2016-12-14 — — EP claimed
WO-2015114452-A2 ANTIBACTERIAL COMPOUNDS BIOTA EUROPE LTD (GB) 2015-08-06 — — WO claimed
EP-3102203-A2 ANTIBACTERIAL COMBINATIONS COMPRISING POLYMYXIN SPERO GYRASE, INC. (US) 2016-12-14 — — EP disclosed
WO-2015114452-A2 ANTIBACTERIAL COMPOUNDS BIOTA EUROPE LTD (GB) 2015-08-06 — — WO disclosed
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