SCHEMBL9203570

SCHEMBL9203570

Clc1cc2ccc(CBr)nc2cc1Cl

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 1/20 0.48
MMP1 P03956 1/20 0.34
MMP2 P08253 1/20 0.34
MMP3 P08254 1/20 0.34
TERT O14746 2/20 0.33
KMT2A Q03164 2/20 0.33
NPSR1 Q6W5P4 1/20 0.33
APP P05067 1/20 0.32
MAPK13 O15264 1/20 0.32
CDK1 P06493 1/20 0.32
PIM1 P11309 1/20 0.32
DYRK1A Q13627 1/20 0.32
PIM3 Q86V86 1/20 0.32
CLK4 Q9HAZ1 1/20 0.32
PDE10A Q9Y233 2/20 0.32
HTT P42858 2/20 0.31
GAA P10253 1/20 0.31
NQO2 P16083 1/20 0.31
CASP6 P55212 1/20 0.31
MEN1 O00255 1/20 0.30

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
SCHEMBL4059987 0.85 CCR1 (0.42) CCR1TERTPDE10A
SCHEMBL6088485 0.82 KMT2A (0.41) MMP1MMP2MMP3TERTKMT2A
SCHEMBL29518426 0.80 CCR1 (0.48) CCR1DYRK1APDE10ALMNAHRH3
SCHEMBL203068 0.80 CCR1 (0.48) CCR1DYRK1APDE10ALMNAHRH3
SCHEMBL201434 0.78 CCR1 (0.47) CCR1DYRK1APDE10AHRH3ALDH1A1
SCHEMBL4061337 0.76 CCR1 (0.48) CCR1TERTKMT2AAPPPDE10A
SCHEMBL23165764 0.76 CCR1 (0.44) CCR1PDE10A
SCHEMBL11873896 0.73 CCR1 (0.50) CCR1TERTALDH1A1
SCHEMBL10402926 0.73 BACE1 (0.53) CCR1KMT2ADYRK1APDE10AHTT
SCHEMBL1193428 0.72 CCR1 (0.48) CCR1TERTKMT2APDE10APDGFRB

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
EP-0399818-B1 Diarylstyrylquinoline diacids MERCK FROSST CANADA INC (CA) 1995-08-16 EP disclosed
EP-0419049-B1 (Quinolin-2-ylmethoxy) indoles as inhibitors of the biosynthesis of leukotrienes MERCK FROSST CANADA INC (CA) 1995-04-12 EP disclosed
US-5380850-A Quinoline hydrazine intermediates MERCK FROSST CANADA, INC. (CA) 1995-01-10 US disclosed
WO-1994013293-A2 (QUINOLIN-2-YLMETHOXY)INDOLES AS INHIBITORS OF THE BIOSYNTHESIS OF LEUKOTRIENES MERCK FROSST CANADA INC. (CA) 1994-06-23 WO disclosed
US-5272145-A (Quinolin-2-ylmethoxy)indoles as inhibitors of the biosynthesis of leukotrienes MERCK FROSST CANADA, INC. (CA) 1993-12-21 US disclosed
US-5204344-A (Quinolin-2-ylmethoxy)indoles as inhibitors of the biosynthesis of leukotrienes MERCK FROSST CANADA, INC. (CA) 1993-04-20 US disclosed
US-5204358-A Antiallergens; antiinflammatory agents; treatment of asthma, rhinitis, bronchitis and skin diseases MERCK FROSST CANADA, INC. (CA) 1993-04-20 US disclosed
US-5104882-A Leukotriene antagonists MERCK FROSST CANADA, INC. (CA) 1992-04-14 US disclosed
EP-0419049-A1 (Quinolin-2-ylmethoxy) indoles as inhibitors of the biosynthesis of leukotrienes MERCK FROSST CANADA INC. (CA) 1991-03-27 EP disclosed
EP-0399818-A1 Diarylstyrylquinoline diacids MERCK FROSST CANADA INC. (CA) 1990-11-28 EP disclosed