SCHEMBL14175271

SCHEMBL14175271

Cc1ccc(NCCN2CCCCC2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.55
KMT2A Q03164 4/20 0.55
MEN1 O00255 3/20 0.55
HRH3 Q9Y5N1 1/20 0.53
NPSR1 Q6W5P4 1/20 0.53
HRH1 P35367 1/20 0.51
ADRA2A P08913 1/20 0.51
ADRA2B P18089 1/20 0.51
ADRA2C P18825 1/20 0.51
POLB P06746 2/20 0.49
KDM4E B2RXH2 1/20 0.49
ALDH1A1 P00352 1/20 0.49
GAA P10253 1/20 0.49
HPGD P15428 1/20 0.49
GFER P55789 1/20 0.49
HSD17B10 Q99714 1/20 0.49
MBTD1 Q05BQ5 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
ESRRG P62508 2/20 0.46
ACHE P22303 2/20 0.46

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
SCHEMBL13102339 0.98 MAPT (0.57) MAPTKMT2AMEN1HRH3NPSR1
SCHEMBL14924426 0.86 MAPT (0.55) MAPTNPSR1ADRA2AADRA2BADRA2C
SCHEMBL1844995 0.83 NPC1 (0.50) KMT2AHRH3ADRA2AADRA2BADRA2C
SCHEMBL13841388 0.83 TSHR (0.60) MAPTKMT2AMEN1POLBKDM4E
SCHEMBL14466590 0.83 MAPT (0.52) MAPTKMT2AMEN1HRH3NPSR1
SCHEMBL23671492 0.82 SIGMAR1 (0.56) ADRA2AADRA2BADRA2CKDM4EALDH1A1
SCHEMBL4804050 0.82 ALDH1A1 (0.50) MAPTKMT2AMEN1HRH3NPSR1
SCHEMBL10891769 0.82 CNR1 (0.59) KMT2AMEN1HRH3POLBKDM4E
SCHEMBL8673780 0.81 POLB (0.59) MAPTKMT2AMEN1HRH3NPSR1
Hydrochloric Acid SCHEMBL11758276 0.80 MAPT (0.58) MAPTKMT2AMEN1HRH3POLB

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
US-7384952-B2 Pyrazolopyrimidine compound and a process for preparing the same MITSUBISHI TANABE PHARMA CORPORATION (JP) 2008-06-10 US disclosed
US-7384952-B2 Pyrazolopyrimidine compound and a process for preparing the same MITSUBISHI TANABE PHARMA CORPORATION (JP) 2008-06-10 US disclosed
EP-1857459-A2 Pyrazolopyrimidine compound and a process for preparing the same TANABE SEIYAKU CO., LTD. (JP) 2007-11-21 EP disclosed