SCHEMBL7749185

SCHEMBL7749185

O=Cc1ccnc2c1ccc1cccnc12

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 6/20 0.72
CCR8 P51685 6/20 0.72
CCR5 P51681 4/20 0.72
L3MBTL1 Q9Y468 5/20 0.57
KDM4E B2RXH2 4/20 0.55
LMNA P02545 4/20 0.55
MAPT P10636 4/20 0.55
HSP90AA1 P07900 2/20 0.55
HTT P42858 2/20 0.55
SMN1; SMN2 Q16637 2/20 0.55
TDP1 Q9NUW8 2/20 0.55
GMNN O75496 1/20 0.55
TP53 P04637 1/20 0.55
MMP2 P08253 1/20 0.55
CYP3A4 P08684 1/20 0.55
CYP2D6 P10635 1/20 0.55
MMP9 P14780 1/20 0.55
ALOX15 P16050 1/20 0.55
TSHR P16473 1/20 0.55
NFKB1 P19838 1/20 0.55

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
SCHEMBL1088410 0.85 CCR1 (1.00) CCR1CCR8CCR5L3MBTL1KDM4E
SCHEMBL9525875 0.84 CCR1 (0.50) CCR1CCR8CCR5L3MBTL1KDM4E
SCHEMBL9525871 0.84 CCR1 (0.50) CCR1CCR8CCR5L3MBTL1KDM4E
SCHEMBL5159958 0.83 CCR1 (0.57) CCR1CCR8CCR5L3MBTL1KDM4E
SCHEMBL3098572 0.83 CCR1 (0.67) CCR1CCR8CCR5L3MBTL1KDM4E
SCHEMBL28476204 0.81 CCR1 (0.61) CCR1CCR8CCR5L3MBTL1KDM4E
SCHEMBL28477371 0.79 CCR1 (0.59) CCR1CCR8CCR5L3MBTL1KDM4E
SCHEMBL7749257 0.79 CCR1 (0.53) CCR1CCR8CCR5L3MBTL1KDM4E
SCHEMBL7749251 0.79 CCR1 (0.53) CCR1CCR8CCR5L3MBTL1KDM4E
SCHEMBL12669534 0.79 CCR1 (0.49) CCR1CCR8CCR5L3MBTL1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111269268-A Ru complex with dual-emission property, Ru complex with dual-emission property and blank coordination sites and dual-emission complex 湘潭大学 2020-06-12 CN claimed
WO-2024084122-A1 BODIPY-DERIVED COMPOUNDS FOR DRUG DETECTION UNIVERSITAT DE VALÈNCIA (ES) 2024-04-25 WO disclosed
CN-111269268-A Ru complex with dual-emission property, Ru complex with dual-emission property and blank coordination sites and dual-emission complex 湘潭大学 2020-06-12 CN disclosed
CN-103435544-A Quinolone compound OTSUKA PHARMA CO LTD 2013-12-11 CN disclosed
CN-102239147-A Quinolone compound and pharmaceutical composition OTSUKA PHARMA CO LTD 2011-11-09 CN disclosed
US-7514404-B2 PNA-neamine conjugates and methods for producing and using the same UNIVERSITY OF MEDICINE & DENTISTRY OF NEW JERSEY (US) 2009-04-07 US disclosed
CN-1187352-C Phenanthroline-7-one derivatives and their therapeutic use LAFON LABOR (FR) 2005-02-02 CN disclosed
CN-1373761-A Phenanthroline-7-one derivatives and their therapeutic use LAFON LABOR (FR) 2002-10-09 CN disclosed
WO-2001034682-A1 PHOSPHORESCENT OXYGEN SENSORS MANNERS IAN (CA) 2001-05-17 WO disclosed