SCHEMBL11908005

SCHEMBL11908005

N#Cc1cc2cccnc2c2ncccc12

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 5/20 0.56
CCR8 P51685 5/20 0.56
L3MBTL1 Q9Y468 4/20 0.56
ALDH1A1 P00352 3/20 0.49
MAPT P10636 2/20 0.49
CCR5 P51681 3/20 0.47
HSP90AA1 P07900 2/20 0.47
LMNA P02545 2/20 0.47
KDM4E B2RXH2 2/20 0.47
GMNN O75496 1/20 0.47
TP53 P04637 1/20 0.47
MMP2 P08253 1/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2D6 P10635 1/20 0.47
MMP9 P14780 1/20 0.47
ALOX15 P16050 1/20 0.47
TSHR P16473 1/20 0.47
NFKB1 P19838 1/20 0.47
MMP8 P22894 1/20 0.47
THPO P40225 1/20 0.47

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
SCHEMBL17954573 0.85 CCR1 (0.51) CCR1CCR8L3MBTL1ALDH1A1MAPT
SCHEMBL17146663 0.84 CCR1 (0.41) CCR1CCR8L3MBTL1ALDH1A1MAPT
SCHEMBL17178123 0.81 LRRK2 (0.39) CCR1CCR8L3MBTL1ALDH1A1LMNA
SCHEMBL1994006 0.81 CCR1 (0.57) CCR1CCR8L3MBTL1MAPTCCR5
SCHEMBL29590403 0.78 CCR1 (0.52) CCR1CCR8L3MBTL1MAPTCCR5
SCHEMBL241397 0.78 CCR1 (0.52) CCR1CCR8L3MBTL1MAPTCCR5
SCHEMBL30196385 0.77 ALDH1A1 (0.44) CCR1CCR8L3MBTL1ALDH1A1MAPT
SCHEMBL26749740 0.77 ALDH1A1 (0.44) CCR1CCR8L3MBTL1ALDH1A1MAPT
SCHEMBL12914331 0.77 L3MBTL1 (0.68) CCR1CCR8L3MBTL1ALDH1A1MAPT
SCHEMBL20554541 0.75 SLC40A1 (0.46) CCR1CCR8L3MBTL1ALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230167144-A1 PREPARATION AND ITS APPLICATION OF A CYANIDE-BRIDGED METAL ORGANIC COMPOUND WITH INTRAMOLECULAR MAGNETIC TRANSFORMATION Hubei Jingmen Industrial Technology Research Institute Co., Ltd. (CN) 2023-06-01 US claimed
CN-111718381-A Osmium metal organic compound containing polypyridine ligand and preparation method and application thereof 荆楚理工学院 2020-09-29 CN claimed
CN-111518145-A Cyanide-bridged metal organic compound with intramolecular magnetic transformation, and preparation method and application thereof 荆楚理工学院 2020-08-11 CN claimed
CN-111518145-B Cyano-bridged metal organic compound with intramolecular magnetic transformation and preparation method and application thereof 荆楚理工学院 2023-06-20 CN disclosed
US-20230167144-A1 PREPARATION AND ITS APPLICATION OF A CYANIDE-BRIDGED METAL ORGANIC COMPOUND WITH INTRAMOLECULAR MAGNETIC TRANSFORMATION Hubei Jingmen Industrial Technology Research Institute Co., Ltd. (CN) 2023-06-01 US disclosed
CN-111718381-A Osmium metal organic compound containing polypyridine ligand and preparation method and application thereof 荆楚理工学院 2020-09-29 CN disclosed
CN-111518145-A Cyanide-bridged metal organic compound with intramolecular magnetic transformation, and preparation method and application thereof 荆楚理工学院 2020-08-11 CN disclosed
WO-2015037675-A1 BENZOTHIENOPYRIMIDINE COMPOUND, METHOD FOR PRODUCING SAME AND ORGANIC ELECTROLUMINESCENT ELEMENT CONTAINING SAME 東ソー株式会社 (JP) 2015-03-19 WO disclosed
US-8450440-B2 Method for purifying polymer and polymer MITSUI CHEMICALS, INC. (JP) 2013-05-28 US disclosed
US-20120208976-A1 METHOD FOR PURIFYING POLYMER AND POLYMER MITSUI CHEMICALS, INC (JP) 2012-08-16 US disclosed