SCHEMBL9844289

SCHEMBL9844289

CCOC(=O)N1CCC(=C2c3ccccc3CSc3ccccc32)CC1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FNTA P49354 3/20 0.61
FNTB P49356 3/20 0.61
HRH1 P35367 7/20 0.59
PTAFR P25105 1/20 0.50
SLC6A15 Q9H2J7 6/20 0.48
LMNA P02545 2/20 0.48
CYP3A4 P08684 2/20 0.48
CHRM2 P08172 2/20 0.48
ADORA3 P0DMS8 2/20 0.48
CYP2D6 P10635 2/20 0.48
TBXA2R P21731 2/20 0.48
CYP2C19 P33261 2/20 0.48
OPRM1 P35372 2/20 0.48
SLC6A3 Q01959 2/20 0.48
KCNH2 Q12809 2/20 0.48
MAPT P10636 2/20 0.48
MEN1 O00255 1/20 0.48
NPC1 O15118 1/20 0.48
CACNA1F O60840 1/20 0.48
NR1I2 O75469 1/20 0.48

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
SCHEMBL13870604 0.89 HRH1 (0.50) FNTAFNTBHRH1PTAFRSLC6A15
SCHEMBL7676741 0.86 FNTA (0.53) FNTAFNTBHRH1PTAFRSLC6A15
SCHEMBL12854667 0.86 FNTA (0.59) FNTAFNTBHRH1PTAFRSLC6A15
SCHEMBL9844364 0.86 CHRM2 (0.57) HRH1PTAFRSLC6A15LMNACYP3A4
SCHEMBL9850494 0.85 HRH1 (0.76) FNTAFNTBHRH1PTAFRSLC6A15
SCHEMBL7679490 0.84 FNTA (0.52) FNTAFNTBHRH1PTAFRLMNA
SCHEMBL7682654 0.82 FNTA (0.50) FNTAFNTBHRH1PTAFRLMNA
SCHEMBL9631337 0.81 HRH1 (0.62) HRH1PTAFRSLC6A15LMNACYP3A4
SCHEMBL7303012 0.81 FNTA (0.52) FNTAFNTBHRH1PTAFRLMNA
SCHEMBL9718766 0.79 HRH1 (0.61) FNTAFNTBHRH1PTAFRSLC6A15

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
EP-0451772-A1 Piperidine compounds, method for preparation thereof, and a pharamceutical composition comprising the same HOKURIKU PHARMACEUTICAL CO., LTD. (JP) 1991-10-16 EP disclosed