SCHEMBL7146864

SCHEMBL7146864

CCc1cc2c(cc1OC)C1=C(c3ccccc3CC1)C2c1ccc(OCCN2CCCCC2)cc1

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 3/20 0.45
KCNH2 Q12809 1/20 0.45
EBP Q15125 1/20 0.45
SIGMAR1 Q99720 1/20 0.45
MCHR1 Q99705 1/20 0.44
ESR1 P03372 10/20 0.43
ESR2 Q92731 9/20 0.42
ACHE P22303 1/20 0.42
HTR2C P28335 1/20 0.41

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
SCHEMBL7138152 0.92 HRH3 (0.48) HRH3KCNH2EBPSIGMAR1MCHR1
SCHEMBL7143807 0.92 EBP (0.51) HRH3EBPSIGMAR1ESR1ESR2
SCHEMBL7146901 0.92 EBP (0.49) HRH3KCNH2EBPSIGMAR1MCHR1
SCHEMBL7145591 0.90 HRH3 (0.46) HRH3KCNH2EBPSIGMAR1MCHR1
SCHEMBL7144261 0.89 HRH3 (0.46) HRH3KCNH2EBPSIGMAR1MCHR1
SCHEMBL7143811 0.89 HRH3 (0.46) HRH3KCNH2EBPSIGMAR1MCHR1
SCHEMBL7144833 0.86 ESR1 (0.54) HRH3KCNH2EBPSIGMAR1MCHR1
SCHEMBL7136715 0.85 ESR1 (0.55) HRH3KCNH2EBPSIGMAR1MCHR1
SCHEMBL7141192 0.84 EBP (0.54) HRH3EBPSIGMAR1ESR1ESR2
SCHEMBL7144936 0.82 EBP (0.49) HRH3KCNH2EBPSIGMAR1ESR1

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-0832880-B1 Dihydrobenzofluorene compounds, intermediates, compositions, and methods LILLY CO ELI (US) 2003-07-02 EP disclosed
EP-0832880-A1 Dihydrobenzofluorene compounds, intermediates, compositions, and methods ELI LILLY AND COMPANY (US) 1998-04-01 EP disclosed