SCHEMBL4313601

SCHEMBL4313601

c1ccc2c(c1)Sc1ccccc1N2CC1CO1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP2D6 P10635 2/20 0.53
▸ CYP1A2 P05177 1/20 0.53
▸ CHRM2 P08172 2/20 0.51
▸ ADRA2A P08913 2/20 0.51
▸ CHRM1 P11229 2/20 0.51
▸ ADRA2B P18089 2/20 0.51
▸ CHRM3 P20309 2/20 0.51
▸ DRD1 P21728 2/20 0.51
▸ SLC6A2 P23975 2/20 0.51
▸ HTR2A P28223 2/20 0.51
▸ SLC6A4 P31645 2/20 0.51
▸ ADRA1A P35348 2/20 0.51
▸ HRH1 P35367 2/20 0.51
▸ DRD3 P35462 2/20 0.51
▸ HTR2B P41595 2/20 0.51
▸ SLC6A3 Q01959 2/20 0.51
▸ KCNH2 Q12809 2/20 0.51
▸ EGFR P00533 1/20 0.51
▸ POLB P06746 1/20 0.51
▸ HTR1A P08908 1/20 0.51

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
SCHEMBL14809789 0.84 FPR2 (0.57) CYP2D6CYP1A2CHRM2ADRA2ACHRM1
SCHEMBL4845703 0.82 HTR1A (0.58) CYP2D6CYP1A2CHRM2ADRA2ACHRM1
SCHEMBL14707008 0.76 HTR2A (0.47) CYP2D6CYP1A2CHRM2ADRA2ACHRM1
SCHEMBL14707083 0.76 HTR2A (0.47) CYP2D6CYP1A2CHRM2ADRA2ACHRM1
SCHEMBL15981159 0.76 DHFR (0.41) ADRA2AHTR2AADRA1AHRH1DRD3
SCHEMBL7167351 0.76 HTR2A (0.47) CYP2D6CYP1A2CHRM2ADRA2ACHRM1
SCHEMBL14196858 0.76 HDAC6 (0.43) CYP2D6CYP1A2CHRM2ADRA2ACHRM1
SCHEMBL12424112 0.75 MAPT (0.46) CYP2D6CYP1A2POLBMAPTNPSR1
SCHEMBL13410830 0.75 MAPT (0.46) CYP2D6CYP1A2CHRM2ADRA2ACHRM1
SCHEMBL14264321 0.73 SNCA (0.45) CYP2D6CYP1A2CHRM2ADRA2ACHRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7524590-B2 Methods for storing holographic data and articles having enhanced data storage lifetime derived therefrom GENERAL ELECTRIC COMPANY (US) 2009-04-28 — — US disclosed
WO-2007067670-A2 METHODS FOR STORING HOLOGRAPHIC DATA AND ARTICLES HAVING ENHANCED DATA STORAGE LIFETIME DERIVED THEREFROM GENERAL ELECTRIC COMPANY (US) 2007-06-14 — — WO disclosed
US-20070127329-A1 Methods for storing holographic data and articles having enhanced data storage lifetime derived therefrom GENERAL ELECTRIC COMPANY (US) 2007-06-07 — — US disclosed
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