SCHEMBL6254518

SCHEMBL6254518

CCNCc1ccc(C(=O)N2CCN(c3cnn(Cc4cccc(OCC)c4)c3)CC2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 6/20 0.51
▸ MAPT P10636 4/20 0.51
▸ PKM P14618 4/20 0.49
▸ SMN1; SMN2 Q16637 4/20 0.49
▸ NPSR1 Q6W5P4 3/20 0.49
▸ USP2 O75604 2/20 0.49
▸ ALDH1A1 P00352 2/20 0.47
▸ THRB P10828 1/20 0.44
▸ MAPK1 P28482 1/20 0.44
▸ ALOX15 P16050 1/20 0.43
▸ KLKB1 P03952 2/20 0.43
▸ FAAH O00519 1/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ TSHR P16473 1/20 0.42
▸ HTT P42858 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ CCKAR P32238 1/20 0.42
▸ KLK1 P06870 1/20 0.42
▸ KDM4E B2RXH2 1/20 0.42
▸ DCTPP1 Q9H773 1/20 0.42

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
SCHEMBL27462030 0.90 LMNA (0.51) LMNAMAPTPKMSMN1; SMN2NPSR1
SCHEMBL27445974 0.88 LMNA (0.51) LMNAMAPTPKMSMN1; SMN2NPSR1
SCHEMBL6268897 0.82 LMNA (0.46) LMNAMAPTPKMSMN1; SMN2NPSR1
SCHEMBL5068438 0.80 GPR55 (0.45) LMNAMAPTPKMSMN1; SMN2ALDH1A1
SCHEMBL6270137 0.80 LMNA (0.45) LMNAMAPTPKMSMN1; SMN2NPSR1
SCHEMBL27620312 0.80 LMNA (0.45) LMNAMAPTPKMSMN1; SMN2NPSR1
Hydrochloric Acid SCHEMBL5068443 0.80 GPR55 (0.45) LMNAMAPTPKMSMN1; SMN2ALDH1A1
SCHEMBL27441898 0.79 ALDH1A1 (0.45) LMNAMAPTPKMSMN1; SMN2ALDH1A1
SCHEMBL27441895 0.79 ALDH1A1 (0.45) LMNAMAPTPKMSMN1; SMN2ALDH1A1
SCHEMBL27639213 0.78 LMNA (0.44) LMNAMAPTPKMSMN1; SMN2NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1585481-A2 PYRAZOLOPYRIMIDINE COMPOUND AND PROCESS FOR PREPARING THE SAME TANABE SEIYAKU CO., LTD. (JP) 2005-10-19 — — EP disclosed
WO-2004064721-A2 A PYRAZOLOPYRIMIDINE COMPOUND AND A PROCESS FOR PREPARING THE SAME TANABE SEIYAKU CO., LTD. (JP) 2004-08-05 — — WO disclosed
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