SCHEMBL2380384

SCHEMBL2380384

CCn1cnc2ccccc21.Cn1cnc2ccccc21

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.65
CYP11B1 P15538 5/20 0.55
CYP11B2 P19099 5/20 0.55
SMN1; SMN2 Q16637 8/20 0.54
LMNA P02545 7/20 0.54
HTT P42858 7/20 0.54
TNF P01375 1/20 0.53
PKM P14618 2/20 0.53
EGLN3 Q9H6Z9 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
KMT2A Q03164 2/20 0.49
MAPT P10636 2/20 0.49
KDM4E B2RXH2 1/20 0.49
NPC1 O15118 1/20 0.49
TP53 P04637 1/20 0.49
GAA P10253 1/20 0.49
NFKB1 P19838 1/20 0.49
RAB9A P51151 1/20 0.49
NFKB2 Q00653 1/20 0.49
RELA Q04206 1/20 0.49

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
SCHEMBL226221 0.91 TDP1 (0.70) TDP1CYP11B1CYP11B2SMN1; SMN2LMNA
SCHEMBL230355 0.86 TDP1 (0.63) TDP1CYP11B1CYP11B2SMN1; SMN2LMNA
SCHEMBL5399 0.85 TDP1 (0.59) TDP1CYP11B1CYP11B2SMN1; SMN2LMNA
SCHEMBL29359161 0.85 TDP1 (0.59) TDP1CYP11B1CYP11B2SMN1; SMN2LMNA
SCHEMBL229631 0.84 TDP1 (0.61) TDP1CYP11B1CYP11B2SMN1; SMN2LMNA
Hydrochloric Acid SCHEMBL7206595 0.83 TDP1 (0.57) TDP1CYP11B1CYP11B2SMN1; SMN2LMNA
Hydrochloric Acid SCHEMBL3713895 0.83 TDP1 (0.57) TDP1CYP11B1CYP11B2SMN1; SMN2LMNA
Iodide SCHEMBL15375366 0.83 TDP1 (0.57) TDP1CYP11B1CYP11B2SMN1; SMN2LMNA
Bromide SCHEMBL6955674 0.83 TDP1 (0.57) TDP1CYP11B1CYP11B2SMN1; SMN2LMNA
SCHEMBL28652434 0.83 TDP1 (0.57) TDP1CYP11B1CYP11B2SMN1; SMN2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8338692-B2 Electrolyte for photoelectric conversion elements, and photoelectric conversion element and dye-sensitized solar cell using the electrolyte THE YOKOHAMA RUBBER CO., LTD. (JP) 2012-12-25 US disclosed
US-8222515-B2 Electrolyte for photoelectric conversion elements, and photoelectric conversion element and dye-sensitized solar cell using the electrolyte THE YOKOHAMA RUBBER CO., LTD. (JP) 2012-07-17 US disclosed
US-20110253202-A1 ELECTROLYTE FOR PHOTOELECTRIC CONVERSION ELEMENTS, AND PHOTOELECTRIC CONVERSION ELEMENT AND DYE-SENSITIZED SOLAR CELL USING THE ELECTROLYTE THE YOKOHAMA RUBBER CO., LTD. (JP) 2011-10-20 US disclosed
US-20110226315-A1 ELECTROLYTE FOR PHOTOELECTRIC CONVERSION ELEMENTS, AND PHOTOELECTRIC CONVERSION ELEMENT AND DYE-SENSITIZED SOLAR CELL USING THE ELECTROLYTE THE YOKOHAMA RUBBER CO., LTD. (JP) 2011-09-22 US disclosed