SCHEMBL17265449

SCHEMBL17265449

Cc1ccc2c(c1)Sc1cc(C)ccc1N2CCCP(=O)(O)O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 3/20 0.44
CYP1A2 P05177 4/20 0.38
CYP2D6 P10635 4/20 0.38
CYP2C19 P33261 2/20 0.38
MEN1 O00255 4/20 0.37
KMT2A Q03164 4/20 0.37
MAPT P10636 4/20 0.37
POLB P06746 2/20 0.37
KDM1A O60341 5/20 0.36
TSHR P16473 3/20 0.36
TP53 P04637 3/20 0.36
PRNP P04156 2/20 0.36
CHRM2 P08172 2/20 0.36
HTR1A P08908 2/20 0.36
ADRA2A P08913 2/20 0.36
CHRM1 P11229 2/20 0.36
DRD2 P14416 2/20 0.36
DRD1 P21728 2/20 0.36
SLC6A2 P23975 2/20 0.36
SLC6A4 P31645 2/20 0.36

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
SCHEMBL17265448 0.89 DRD3 (0.38) DRD3CYP1A2CYP2D6CYP2C19MEN1
SCHEMBL17265447 0.86 DRD3 (0.36) DRD3CYP1A2CYP2D6CYP2C19MEN1
SCHEMBL20215754 0.82 TP53 (0.39) DRD3CYP1A2CYP2D6CYP2C19MEN1
SCHEMBL12905409 0.79 PIM1 (0.57) DRD3CYP1A2CYP2D6CYP2C19MEN1
SCHEMBL13212466 0.79 DRD3 (0.49) DRD3CYP1A2CYP2D6CYP2C19MEN1
SCHEMBL17265450 0.78 DRD2 (0.34) DRD3CYP1A2CYP2D6CYP2C19KDM1A
SCHEMBL4727919 0.77 DRD3 (0.48) DRD3CYP1A2CYP2D6CYP2C19MEN1
SCHEMBL14292118 0.77 DRD3 (0.48) DRD3CYP1A2CYP2D6CYP2C19MEN1
SCHEMBL13212476 0.76 DRD3 (0.47) DRD3CYP1A2CYP2D6CYP2C19MEN1
SCHEMBL13212478 0.76 DRD3 (0.47) DRD3CYP1A2CYP2D6CYP2C19MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9990578-B2 Redox active polymer devices and methods of using and manufacturing the same ARIZON BOARD OF REGENTS ON BEHALF OF ARIZONA STATE UNIVERSITY (US) 2018-06-05 US disclosed
US-9882215-B2 Electrochemical energy storage devices comprising self-compensating polymers ARIZONA BOARD OF REGENTS ON BEHALF OF ARIZONA STATE UNIVERSITY (US) 2018-01-30 US disclosed
US-20150333331-A1 ELECTROCHEMICAL ENERGY STORAGE DEVICES COMPRISING SELF-COMPENSATING POLYMERS U.S. DEPARTMENT OF ENERGY 2015-11-19 US disclosed
US-20150332141-A1 REDOX ACTIVE POLYMER DEVICES AND METHODS OF USING AND MANUFACTURING THE SAME U.S. DEPARTMENT OF ENERGY 2015-11-19 US disclosed
US-20150332141-A1 REDOX ACTIVE POLYMER DEVICES AND METHODS OF USING AND MANUFACTURING THE SAME U.S. DEPARTMENT OF ENERGY 2015-11-19 US disclosed