SCHEMBL10778563

SCHEMBL10778563

CCCCc1ccc2[nH]cc(CC)c2c1

nearest known ligand 0.74

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 5/20 0.74
HTR1D P28221 5/20 0.68
HTR1B P28222 5/20 0.68
GABRA1 P14867 3/20 0.49
GABRB2 P47870 3/20 0.49
MPO P05164 2/20 0.48
TRPV1 Q8NER1 1/20 0.46

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
SCHEMBL29018529 0.90 HTR1A (0.78) HTR1AHTR1DHTR1BMPO
SCHEMBL5471393 0.88 HTR1A (0.70) HTR1AHTR1DHTR1BGABRA1GABRB2
SCHEMBL14692901 0.87 HTR1D (0.72) HTR1AHTR1DHTR1BGABRA1GABRB2
SCHEMBL11290643 0.86 HTR1A (0.72) HTR1AHTR1DHTR1BGABRA1GABRB2
SCHEMBL12013054 0.84 HTR1D (0.73) HTR1AHTR1DHTR1BGABRA1GABRB2
SCHEMBL8299143 0.84 HTR1A (0.77) HTR1AHTR1DHTR1BMPO
SCHEMBL5461625 0.83 HTR1A (0.71) HTR1AHTR1DHTR1BGABRA1GABRB2
SCHEMBL28267254 0.83 HTR1A (0.66) HTR1AHTR1DHTR1BGABRA1GABRB2
SCHEMBL8250982 0.82 HTR1A (0.60) HTR1AHTR1DHTR1BGABRA1GABRB2
SCHEMBL8920992 0.82 HTR1A (0.97) HTR1AHTR1DHTR1BMPO

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-0243122-A2 Piperazine compound as PAF-antagonist FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1987-10-28 EP claimed