SCHEMBL648056

SCHEMBL648056

CCCCn1c(-c2ccccc2)nc(-c2ccccc2)c1[C@H](C)N(Cc1ccc2c(c1)OCC2)CC1CCCCC1

nearest known ligand 0.47

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
C5AR1 P21730 1/20 0.47
CXCR3 P49682 19/20 0.40

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
SCHEMBL649760 1.00 C5AR1 (0.47) C5AR1CXCR3
SCHEMBL1912900 0.91 C5AR1 (0.46) C5AR1CXCR3
SCHEMBL1912902 0.91 C5AR1 (0.46) C5AR1CXCR3
SCHEMBL5134524 0.91 C5AR1 (0.46) C5AR1CXCR3
SCHEMBL1912909 0.89 C5AR1 (0.61) C5AR1CXCR3
SCHEMBL648047 0.89 C5AR1 (0.61) C5AR1CXCR3
SCHEMBL1912912 0.86 C5AR1 (0.62) C5AR1
SCHEMBL651559 0.86 C5AR1 (0.62) C5AR1
SCHEMBL1912913 0.82 C5AR1 (0.40) C5AR1CXCR3
SCHEMBL650465 0.82 C5AR1 (0.40) C5AR1CXCR3

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