SCHEMBL7833790

SCHEMBL7833790

CC(=O)OC(C)CCc1cc(Oc2ccc(Cl)cc2Cl)n2nccc2n1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.38
FFAR1 O14842 2/20 0.36
LOXL2 Q9Y4K0 1/20 0.35
MRGPRX4 Q96LA9 2/20 0.34
SMN1; SMN2 Q16637 4/20 0.34
LMNA P02545 3/20 0.34
ALDH1A1 P00352 2/20 0.34
KDM4E B2RXH2 1/20 0.34
HTT P42858 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
TSHR P16473 1/20 0.33
MAPK1 P28482 1/20 0.33
GAA P10253 2/20 0.33
HPGD P15428 2/20 0.32
NLRP1 Q9C000 1/20 0.32
NPSR1 Q6W5P4 2/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
GPR55 Q9Y2T6 1/20 0.32
KCNJ6 P48051 1/20 0.32

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
SCHEMBL7832654 0.90 LOXL2 (0.39) MAPTLOXL2SMN1; SMN2ALDH1A1KDM4E
SCHEMBL7821319 0.87 LOXL2 (0.40) MAPTFFAR1LOXL2ALDH1A1MAPK1
SCHEMBL7832891 0.86 POLB (0.35) MAPTFFAR1LOXL2MRGPRX4LMNA
SCHEMBL7833781 0.85 LOXL2 (0.47) MAPTLOXL2ALDH1A1HTTL3MBTL1
SCHEMBL7829885 0.82 KDM5A (0.40) KDM4E
SCHEMBL7833969 0.81 LOXL2 (0.50) LOXL2
SCHEMBL7835481 0.81 LOXL2 (0.38) LOXL2SMN1; SMN2ALDH1A1HTT
SCHEMBL7831449 0.81 PDE10A (0.43) MAPTLOXL2SMN1; SMN2TSHR
SCHEMBL7831612 0.81 LOXL2 (0.41) LOXL2LMNA
SCHEMBL7834994 0.77 PRKAB2 (0.36) MAPTLOXL2SMN1; SMN2TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0820997-B1 PYRAZOLO[1,5-a]PYRIMIDINE DERIVATIVES OTSUKA PHARMA CO LTD (JP) 2001-07-25 EP disclosed
US-5985882-A ANALGESICS OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) 1999-11-16 US disclosed
EP-0820997-A1 PYRAZOLO[1,5-a]PYRIMIDINE DERIVATIVES OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) 1998-01-28 EP disclosed