SCHEMBL13576643

SCHEMBL13576643

Clc1ccc(C[C@H]2CCCNC2)cc1

nearest known ligand 0.56

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 1/20 0.53
EED O75530 4/20 0.51
HTR3A P46098 1/20 0.47
HRH4 Q9H3N8 1/20 0.46
HRH3 Q9Y5N1 1/20 0.46
P2RX7 Q99572 1/20 0.45
ALDH1A1 P00352 1/20 0.43

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
SCHEMBL13576618 1.00 KCNH2 (0.53) KCNH2EEDHTR3AHRH4HRH3
SCHEMBL4308696 0.89 GBA1 (0.52) KCNH2HTR3AHRH4HRH3ALDH1A1
SCHEMBL13576622 0.85 EED (0.54) KCNH2EEDHRH4HRH3P2RX7
SCHEMBL3466554 0.83 EED (0.51) EEDHRH4HRH3
SCHEMBL3158864 0.83 EED (0.51) EEDHRH4HRH3
SCHEMBL9748441 0.83 EED (0.51) EEDHRH4HRH3P2RX7ALDH1A1
SCHEMBL3467789 0.83 EED (0.51) EEDHRH4HRH3
SCHEMBL14609341 0.83 EED (0.55) KCNH2EEDHRH4HRH3P2RX7
SCHEMBL8547993 0.82 EED (0.61) EEDHRH4HRH3
SCHEMBL3473180 0.82 EED (0.61) EEDHRH4HRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009148291-A2 3- OR 4-SUBSTITUTED PIPERIDINE COMPOUNDS SK HOLDINGS CO., LTD. (KR) 2009-12-10 WO disclosed