SCHEMBL7206940

SCHEMBL7206940

Cc1ccc(C)c(C(=O)Cc2ccc3[nH]cc(C4CCN(C)CC4)c3c2)c1

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HTR1D P28221 14/20 0.54
HTR1B P28222 14/20 0.54
CYP1A2 P05177 1/20 0.54
CYP3A4 P08684 1/20 0.54
CYP2D6 P10635 1/20 0.54
CYP2C9 P11712 1/20 0.54
THPO P40225 1/20 0.54
HTR1A P08908 3/20 0.53
HTR1F P30939 2/20 0.53
MAPT P10636 1/20 0.52
BLM P54132 1/20 0.52
NPSR1 Q6W5P4 1/20 0.52
DRD2 P14416 1/20 0.48
DRD4 P21917 1/20 0.48
DRD3 P35462 1/20 0.48
APP P05067 1/20 0.47

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
SCHEMBL7200765 0.92 HTR1D (0.54) HTR1DHTR1BCYP1A2CYP3A4CYP2D6
SCHEMBL7202253 0.85 HTR1D (0.53) HTR1DHTR1BCYP1A2CYP3A4CYP2D6
SCHEMBL7203958 0.84 HTR1D (0.55) HTR1DHTR1BCYP1A2CYP3A4CYP2D6
SCHEMBL7201061 0.84 HTR1D (0.56) HTR1DHTR1BCYP1A2CYP3A4CYP2D6
SCHEMBL9764751 0.83 HTR1D (0.65) HTR1DHTR1BCYP1A2CYP3A4CYP2D6
SCHEMBL7205017 0.83 HTR1B (0.55) HTR1DHTR1BCYP1A2CYP3A4CYP2D6
SCHEMBL7208638 0.82 HTR1D (0.54) HTR1DHTR1BCYP1A2CYP3A4CYP2D6
SCHEMBL7204020 0.82 HTR1D (0.53) HTR1DHTR1BCYP1A2CYP3A4CYP2D6
SCHEMBL7205055 0.82 HTR1D (0.56) HTR1DHTR1BCYP1A2CYP3A4CYP2D6
SCHEMBL7204458 0.81 HTR1D (0.52) HTR1DHTR1BCYP1A2CYP3A4CYP2D6

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
US-6608079-B1 Activating serotonin-1F receptors, inhibiting neuronal protein extravasation, treating migraine ELI LILLY AND COMPANY 2003-08-19 US disclosed