SCHEMBL6743565

SCHEMBL6743565

c1ccc(-c2c(-c3cnc4ccccc4c3)sc(-c3cnc4ccccc4c3)c2-c2ccccc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 1/20 0.53
PDGFRB P09619 5/20 0.51
PDGFRA P16234 5/20 0.51
BIRC5 O15392 1/20 0.51
PIK3CD O00329 2/20 0.47
PIK3CA P42336 2/20 0.47
PIK3CB P42338 1/20 0.47
MTOR P42345 1/20 0.47
PIK3CG P48736 1/20 0.47
MAP4K4 O95819 1/20 0.46
CSNK1G2 P78368 1/20 0.46
CLK4 Q9HAZ1 1/20 0.46
MKNK2 Q9HBH9 1/20 0.46
MAP4K5 Q9Y4K4 1/20 0.46
TOP2A P11388 1/20 0.46
TOP2B Q02880 1/20 0.46
CYP1A2 P05177 1/20 0.44
NISCH Q9Y2I1 1/20 0.44
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44

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
SCHEMBL6745931 0.88 CYP2A6 (0.46) CYP2A6PDGFRBPDGFRABIRC5PIK3CD
SCHEMBL6745064 0.85 BIRC5 (0.48) CYP2A6PDGFRBPDGFRABIRC5PIK3CD
SCHEMBL708999 0.80 PDGFRB (0.75) CYP2A6PDGFRBPDGFRABIRC5PIK3CD
SCHEMBL24662776 0.79 CYP2A6 (0.56) CYP2A6PDGFRBPDGFRABIRC5PIK3CD
SCHEMBL26829682 0.78 PDGFRB (0.72) CYP2A6PDGFRBPDGFRABIRC5PIK3CD
SCHEMBL24621829 0.78 PDGFRB (0.72) CYP2A6PDGFRBPDGFRABIRC5PIK3CD
SCHEMBL29375510 0.78 PDGFRB (0.72) CYP2A6PDGFRBPDGFRABIRC5PIK3CD
SCHEMBL2772360 0.78 PDGFRB (0.77) CYP2A6PDGFRBPDGFRABIRC5PIK3CD
SCHEMBL32667946 0.78 PDGFRB (0.77) CYP2A6PDGFRBPDGFRABIRC5PIK3CD
SCHEMBL12580362 0.77 PDGFRB (0.66) CYP2A6PDGFRBPDGFRABIRC5PIK3CD

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-6696182-B2 HIGH PERFORMANCE DIPYRIDYL THIOPHENE OR DIPYRIDYL THIOPHENE DIOXIDE ELECTRON TRANSPORT MATERIALS WHICH WHEN EMPLOYED CAN GIVE LOW-VOLTAGE, HIGH EFFICIENCY ORGANIC ELECTROLUMINESCENT DEVICES CHISSO CORPORATION (JP) 2004-02-24 US disclosed
EP-1186605-B1 Organic electroluminescent device comprising dipyridylthiophene derivative CHISSO CORP (JP) 2003-04-16 EP disclosed
US-20020034658-A1 Organic electroluminescent device comprising dipyridylthiophene derivative CHISSO CORPORATION (JP) 2002-03-21 US disclosed
EP-1186605-A1 Organic electroluminescent device comprising dipyridylthiophene derivative CHISSO CORPORATION (JP) 2002-03-13 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20020034658-A1 Organic electroluminescent device comprising dipyridylthiophene derivative LAGE3, MAL2, ELF3 CYP2A6 3732/4885PDGFRB 4388/4885PDGFRA 3974/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.