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Sugi Predict / Compounds / SCHEMBL1490913

SCHEMBL1490913

SCHEMBL1490913

CC(C)(C)N(CCCn1c(CCl)nc2cnc3ccccc3c21)C(=O)O

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.37
▸ TLR7 Q9NYK1 13/20 0.36
▸ MEN1 O00255 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.34
▸ TSHR P16473 1/20 0.33
▸ L3MBTL1 Q9Y468 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
SCHEMBL1490528 0.94 LMNA (0.38) LMNATLR7MEN1KMT2AMAPT
SCHEMBL2894947 0.89 TLR7 (0.46) TLR7
SCHEMBL2506895 0.89 TLR7 (0.41) TLR7MAPTL3MBTL1
SCHEMBL2889187 0.88 TLR7 (0.44) TLR7
SCHEMBL1490737 0.83 TLR7 (0.51) TLR7
SCHEMBL2516371 0.80 TLR7 (0.36) TLR7
SCHEMBL1775452 0.79 LMNA (0.34) LMNATLR7MAPTNPSR1TSHR
SCHEMBL3865570 0.79 LMNA (0.41) LMNATLR7MEN1KMT2AMAPT
SCHEMBL1231862 0.78 TLR7 (0.33) LMNATLR7MAPTNPSR1L3MBTL1
SCHEMBL2515314 0.78 LMNA (0.31) LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8598192-B2 Hydroxylamine substituted imidazoquinolines 3M INNOVATIVE PROPERTIES COMPANY (US) 2013-12-03 — — US disclosed
US-7897767-B2 Oxime substituted imidazoquinolines 3M INNOVATIVE PROPERTIES COMPANY (US) 2011-03-01 — — US disclosed