SCHEMBL793638

SCHEMBL793638

c1cc2ccc3ccsc3c2s1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 3/20 0.46
HDAC4 P56524 1/20 0.32
AXL P30530 1/20 0.32
MKNK1 Q9BUB5 1/20 0.32
MKNK2 Q9HBH9 1/20 0.32
DAO P14920 1/20 0.31
PIM1 P11309 1/20 0.31
SLC6A2 P23975 1/20 0.31
SLC6A4 P31645 1/20 0.31
SLC6A3 Q01959 1/20 0.31
ADORA3 P0DMS8 1/20 0.31
ADORA2A P29274 1/20 0.31
ADORA2B P29275 1/20 0.31
ADORA1 P30542 1/20 0.31
FBP1 P09467 1/20 0.30
PDPK1 O15530 1/20 0.30
PARP1 P09874 1/20 0.30

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
SCHEMBL15052338 0.88 CYP2A6 (0.40) CYP2A6SLC6A2SLC6A4SLC6A3ADORA3
SCHEMBL10054251 0.84 CYP2A6 (0.41) CYP2A6HDAC4
SCHEMBL2368459 0.84 CYP2A6 (0.41) CYP2A6HDAC4
SCHEMBL19206984 0.82 CYP2A6 (0.40) CYP2A6
SCHEMBL12279072 0.82 CYP2A6 (0.40) CYP2A6
SCHEMBL1041310 0.82 CYP2A6 (0.41) CYP2A6
SCHEMBL24863487 0.80 CYP2A6 (0.39) CYP2A6
SCHEMBL17086906 0.80 CYP2A6 (0.39) CYP2A6
SCHEMBL1617157 0.78 CYP2A6 (0.34) CYP2A6
SCHEMBL19725731 0.76 AXL (0.38) CYP2A6AXLMKNK1MKNK2ADORA3

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 478 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024243195-A1 AQUEOUS ELECTROCHEMICAL CELLS AND COMPONENTS THEREFOR Alsym Energy, Inc. (US) 2024-11-28 WO claimed
US-20240343739-A1 TWO DIMENSIONAL BENZO[4,5]IMIDAZO[2,1-A]ISOINDOLEINCORPORATED NON-FULLERENE ELECTRON ACCEPTORS FOR ORGANIC PHOTOVOLTAIC DEVICES NATIONAL RESEARCH COUNCIL OF CANADA (CA) 2024-10-17 US claimed
EP-4370520-A1 TWO DIMENSIONAL BENZO[4,5]IMIDAZO[2,1-A]ISOINDOLE INCORPORATED NON-FULLERENE ELECTRON ACCEPTORS FOR ORGANIC PHOTOVOLTAIC DEVICES National Research Council of Canada (CA) 2024-05-22 EP claimed
WO-2023283728-A1 TWO DIMENSIONAL BENZO[4,5]IMIDAZO[2,1-A]ISOINDOLE INCORPORATED NON-FULLERENE ELECTRON ACCEPTORS FOR ORGANIC PHOTOVOLTAIC DEVICES NATIONAL RESEARCH COUNCIL OF CANADA (CA) 2023-01-19 WO claimed
EP-2501698-B1 FLUORINATED MONOMERS, OLIGOMERS AND POLYMERS FOR USE IN ORGANIC ELECTRONIC DEVICES NAT RES COUNCIL CANADA (CA) 2018-04-25 EP claimed
US-8927684-B2 Fluorinated monomers, oligomers and polymers for use in organic electronic devices NATIONAL RESEARCH COUNCIL OF CANADA (CA) 2015-01-06 US claimed
EP-2501698-A1 FLUORINATED MONOMERS, OLIGOMERS AND POLYMERS FOR USE IN ORGANIC ELECTRONIC DEVICES National Research Council of Canada (CA) 2012-09-26 EP claimed
US-20120232237-A1 Fluorinated Monomers, Oligomers and Polymers for Use in Organic Electronic Devices NATIONAL RESEARCH COUNCIL OF CANADA (CA) 2012-09-13 US claimed
EP-2467371-A2 ORGANIC ELECTRONIC DEVICES AND POLYMERS, INCLUDING PHOTOVOLTAIC CELLS AND DIKETONE-BASED POLYMERS Plextronics, Inc. (US) 2012-06-27 EP claimed
EP-2449561-A2 POLYMERS COMPRISING AT LEAST ONE BITHIOPHENE REPEAT UNIT, METHODS SYNTHETISING SAID POLYMERS AND COMPOSITIONS COMPRISING THE SAME Plextronics, Inc. (US) 2012-05-09 EP claimed
US-20110204341-A1 ORGANIC ELECTRONIC DEVICES AND POLYMERS, INCLUDING PHOTOVOLTAIC CELLS AND DIKETONE-BASED POLYMERS PLEXTRONICS, INC. 2011-08-25 US claimed
WO-2011060526-A1 FLUORINATED MONOMERS, OLIGOMERS AND POLYMERS FOR USE IN ORGANIC ELECTRONIC DEVICES NATIONAL RESEARCH COUNCIL OF CANADA (CA) 2011-05-26 WO claimed
WO-2011028827-A2 ORGANIC ELECTRONIC DEVICES AND POLYMERS, INCLUDING PHOTOVOLTAIC CELLS AND DIKETONE-BASED POLYMERS PLEXTRONICS, INC. (US) 2011-03-10 WO claimed
WO-2011002927-A2 NOVEL COMPOSITIONS, METHODS AND POLYMERS PLEXTRONICS, INC. (US) 2011-01-06 WO claimed
US-7351266-B2 Keratin dyeing compounds, keratin dyeing compositions containing them, and use thereof THE PROCTER & GAMBLE COMPANY (US) 2008-04-01 US claimed
EP-1720615-A1 KERATIN DYEING COMPOUNDS, KERATIN DYEING COMPOSITIONS CONTAINING THEM, AND USE THEREOF The Procter and Gamble Company (US) 2006-11-15 EP claimed
WO-2005087187-A1 KERATIN DYEING COMPOUNDS, KERATIN DYEING COMPOSITIONS CONTAINING THEM, AND USE THEREOF THE PROCTER & GAMBLE COMPANY (US) 2005-09-22 WO claimed
US-20050193504-A1 Keratin dyeing compounds, keratin dyeing compositions containing them, and use thereof PROCTER & GAMBLE COMPANY, THE 2005-09-08 US claimed
CN-122055347-A Oligomeric binaphthyl compounds and thermoplastic resins 三菱瓦斯化学株式会社 2026-05-15 CN disclosed
US-20050193504-A1 Keratin dyeing compounds, keratin dyeing compositions containing them, and use thereof PROCTER & GAMBLE COMPANY, THE 2005-09-08 US 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 (3 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-20050193504-A1 Keratin dyeing compounds, keratin dyeing compositions containing them, and use thereof KRT18, CKMT1A; CKMT1B, KRTCAP2 CYP2A6 405/4885HDAC4 826/4885AXL 3737/4885
US-20240343739-A1 TWO DIMENSIONAL BENZO[4,5]IMIDAZO[2,1-A]ISOINDOLEINCORPORATED NON-FULLERENE ELECTRON ACCEPTORS FOR ORGANIC PHOTOVOLTAIC DEVICES WASF2, OPRM1, VDAC2 CYP2A6 1303/4885HDAC4 4518/4885AXL 1174/4885
US-20120232237-A1 Fluorinated Monomers, Oligomers and Polymers for Use in Organic Electronic Devices NR1I2, NR1I3, NR2C2 CYP2A6 1047/4885HDAC4 3605/4885AXL 284/4885

“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.