SCHEMBL649322

SCHEMBL649322

CCCCn1c(-c2c(C)cccc2C)nc(Cl)c1CN(Cc1cccc(OCC)c1)CC(C)(C)C

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SQLE Q14534 4/20 0.35
BCHE P06276 5/20 0.35
TLR7 Q9NYK1 7/20 0.35
DHFR P00374 3/20 0.34
HSP90AA1 P07900 1/20 0.34
HSP90AB1 P08238 1/20 0.34

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
SCHEMBL649555 0.85 SMN1; SMN2 (0.35) TLR7HSP90AA1HSP90AB1
SCHEMBL648275 0.82 TLR7 (0.34) SQLEBCHETLR7
SCHEMBL651129 0.82 MAPT (0.42) BCHETLR7
SCHEMBL651294 0.81 BCHE (0.40) BCHETLR7
SCHEMBL650627 0.79 BCHE (0.43) BCHETLR7
SCHEMBL650387 0.78 BCHE (0.35) BCHETLR7
SCHEMBL651362 0.76 CRHR1 (0.35) BCHE
SCHEMBL648590 0.76 C5AR1 (0.40)
SCHEMBL648961 0.74 TLR7 (0.36) BCHETLR7
SCHEMBL648633 0.73 C5AR1 (0.50) TLR7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8119665-B2 Aryl imidazoles and related compounds as C5a receptor modulators NOVARTIS INTERNATIONAL PHARMACEUTICAL LTD. (BM) 2012-02-21 US disclosed
US-8119665-B2 Aryl imidazoles and related compounds as C5a receptor modulators NOVARTIS INTERNATIONAL PHARMACEUTICAL LTD. (BM) 2012-02-21 US disclosed
US-8119665-B2 Aryl imidazoles and related compounds as C5a receptor modulators NOVARTIS INTERNATIONAL PHARMACEUTICAL LTD. (BM) 2012-02-21 US disclosed
US-7186734-B2 Aryl imidazoles and related compounds as C5a receptor modulators NEUROGEN CORPORATION (US) 2007-03-06 US disclosed
US-7186734-B2 Aryl imidazoles and related compounds as C5a receptor modulators NEUROGEN CORPORATION (US) 2007-03-06 US disclosed
US-7186734-B2 Aryl imidazoles and related compounds as C5a receptor modulators NEUROGEN CORPORATION (US) 2007-03-06 US disclosed