SCHEMBL4768192

SCHEMBL4768192

C1CN[C](C2CCNCC2)C1

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 1/20 0.37
SLC18A3 Q16572 1/20 0.37
SIGMAR1 Q99720 1/20 0.37
OR51E2 Q9H255 1/20 0.33
HTR2C P28335 6/20 0.32
HTR3A P46098 1/20 0.32
MAPT P10636 1/20 0.32
THRB P10828 1/20 0.32
HRH3 Q9Y5N1 1/20 0.32
BCHE P06276 1/20 0.32
ACHE P22303 1/20 0.32
GABRA1 P14867 2/20 0.31
GABRG2 P18507 2/20 0.31
GABRB3 P28472 2/20 0.31
PLG P00747 1/20 0.31
QDPR P09417 1/20 0.31

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
SCHEMBL6322559 0.80
SCHEMBL6319373 0.78
SCHEMBL27829921 0.78 NISCH (0.35) HRH4
SCHEMBL310610 0.76 NISCH (0.39)
SCHEMBL11257556 0.75
SCHEMBL205175 0.74
SCHEMBL18763487 0.70
SCHEMBL3764762 0.66
SCHEMBL28247554 0.65 SLC18A3 (0.39) HRH4SLC18A3SIGMAR1HTR2CHTR3A
SCHEMBL11258641 0.62 HRH4 (0.37) HRH4SLC18A3SIGMAR1HTR2CHTR3A

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-2007733-A1 AMIDE SUBSTITUTED INDAZOLE AND BENZOTRIAZOLE DERIVATIVES AS POLY(ADP-RIBOSE)POLYMERASE (PARP) INHIBITORS Istituto di Richerche di Biologia Molecolare P. Angeletti S.p.A. (IT) 2008-12-31 EP disclosed
WO-2007113596-A1 AMIDE SUBSTITUTED INDAZOLE AND BENZOTRIAZOLE DERIVATIVES AS POLY(ADP-RIBOSE)POLYMERASE (PARP) INHIBITORS ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI SPA (IT) 2007-10-11 WO disclosed