SCHEMBL6269923

SCHEMBL6269923

CCOc1cccc(Cn2cc(N3CCN(C(=O)[C@H]4CC[C@H](N5CCCC5)CC4)CC3)cn2)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 5/20 0.45
▸ ALDH1A1 P00352 4/20 0.45
▸ KDM4E B2RXH2 3/20 0.45
▸ HTT P42858 2/20 0.45
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ MAPT P10636 6/20 0.42
▸ KMT2A Q03164 4/20 0.40
▸ MEN1 O00255 2/20 0.40
▸ FAAH O00519 1/20 0.40
▸ MAPK1 P28482 3/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ CYP2D6 P10635 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39
▸ TP53 P04637 2/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ POLB P06746 1/20 0.39
▸ PKM P14618 1/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ CYP2C9 P11712 1/20 0.39

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
SCHEMBL27639346 0.99 LMNA (0.46) LMNAALDH1A1KDM4EHTTL3MBTL1
SCHEMBL6268901 0.94 LMNA (0.44) LMNAALDH1A1KDM4EHTTL3MBTL1
SCHEMBL27441898 0.87 ALDH1A1 (0.45) LMNAALDH1A1KDM4EHTTMAPT
SCHEMBL27441895 0.87 ALDH1A1 (0.45) LMNAALDH1A1KDM4EHTTMAPT
SCHEMBL6253936 0.86 LMNA (0.44) LMNAALDH1A1KDM4EHTTMAPT
SCHEMBL27489532 0.83 KDM4E (0.42) LMNAALDH1A1KDM4EHTTMAPT
SCHEMBL27639303 0.83 KDM4E (0.42) LMNAALDH1A1KDM4EHTTMAPT
SCHEMBL6267847 0.82 LMNA (0.40) LMNAALDH1A1KDM4EHTTMAPT
SCHEMBL27463399 0.82 LMNA (0.40) LMNAALDH1A1KDM4EHTTMAPT
SCHEMBL27463835 0.81 KDM4E (0.39) LMNAALDH1A1KDM4EHTTMAPT

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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