SCHEMBL1912876

SCHEMBL1912876

CCCCn1c(-c2ccccc2)nc(S(=O)(=O)c2ccccc2)c1CN(Cc1ccc2c(c1)OCO2)Cc1ccc2c(c1)OCO2

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
C5AR1 P21730 1/20 0.59
LMNA P02545 4/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
HTR6 P50406 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
ALDH1A1 P00352 2/20 0.40
HPGD P15428 1/20 0.40
HSD17B10 Q99714 1/20 0.40
KMT2A Q03164 2/20 0.39
GAA P10253 1/20 0.39
PTGES O14684 1/20 0.39
ALOX5 P09917 1/20 0.39
PPARG P37231 1/20 0.38
PPARA Q07869 1/20 0.38
TSHR P16473 1/20 0.38
PKM P14618 1/20 0.38
HSP90AA1 P07900 2/20 0.38
HSP90AB1 P08238 2/20 0.38
F2R P25116 2/20 0.38

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
SCHEMBL647923 0.91 C5AR1 (0.61) C5AR1LMNASMN1; SMN2L3MBTL1TDP1
SCHEMBL650114 0.86 C5AR1 (0.63) C5AR1LMNASMN1; SMN2L3MBTL1TDP1
SCHEMBL1913049 0.86 C5AR1 (0.67) C5AR1LMNASMN1; SMN2L3MBTL1TDP1
SCHEMBL4767016 0.85 C5AR1 (0.75) C5AR1LMNASMN1; SMN2L3MBTL1TDP1
SCHEMBL649661 0.85 C5AR1 (0.66) C5AR1LMNASMN1; SMN2L3MBTL1TDP1
SCHEMBL650279 0.84 C5AR1 (0.64) C5AR1LMNASMN1; SMN2L3MBTL1TDP1
SCHEMBL651895 0.84 C5AR1 (0.65) C5AR1LMNASMN1; SMN2L3MBTL1TDP1
SCHEMBL649605 0.84 C5AR1 (0.65) C5AR1LMNASMN1; SMN2L3MBTL1TDP1
SCHEMBL1912761 0.84 C5AR1 (0.65) C5AR1LMNASMN1; SMN2L3MBTL1TDP1
SCHEMBL650388 0.84 C5AR1 (0.65) C5AR1LMNASMN1; SMN2L3MBTL1TDP1

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 8 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
EP-1490044-A4 COMBINATION THERAPY FOR THE TREATMENT OF CONDITIONS WITH PATHOGENIC INFLAMMATORY COMPONENTS NEUROGEN CORP (US) 2008-04-16 EP 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
EP-1490044-A1 COMBINATION THERAPY FOR THE TREATMENT OF CONDITIONS WITH PATHOGENIC INFLAMMATORY COMPONENTS NEUROGEN CORPORATION (US) 2004-12-29 EP disclosed
WO-2003084524-A1 COMBINATION THERAPY FOR THE TREATMENT OF CONDITIONS WITH PATHOGENIC INFLAMMATORY COMPONENTS NEUROGEN CORPORATION (US) 2003-10-16 WO disclosed