SCHEMBL13726745

SCHEMBL13726745

O=C1C(=Cc2ccc(O)cc2)SC(=S)N1c1ccc(Br)cc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSPD1 P10809 1/20 0.71
HSPE1 P61604 1/20 0.71
MAPT P10636 6/20 0.63
MEN1 O00255 6/20 0.63
KMT2A Q03164 6/20 0.63
POLB P06746 3/20 0.63
TDP1 Q9NUW8 2/20 0.63
OPRK1 P41145 1/20 0.63
BLM P54132 1/20 0.63
MCL1 Q07820 4/20 0.62
BCL2 P10415 3/20 0.62
CFTR P13569 1/20 0.60
KDM4E B2RXH2 1/20 0.59
ALDH1A1 P00352 1/20 0.59
LMNA P02545 1/20 0.59
ALOX12 P18054 1/20 0.59
L3MBTL1 Q9Y468 1/20 0.59
THRB P10828 2/20 0.59
RECQL P46063 2/20 0.59
NPC1 O15118 1/20 0.59

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
SCHEMBL13824757 1.00 HSPD1 (0.71) HSPD1HSPE1MAPTMEN1KMT2A
SCHEMBL13726742 1.00 HSPD1 (0.71) HSPD1HSPE1MAPTMEN1KMT2A
SCHEMBL15761667 0.87 HSPD1 (0.71) HSPD1HSPE1MAPTMEN1KMT2A
SCHEMBL18235431 0.86 MEN1 (0.61) HSPD1HSPE1MAPTMEN1KMT2A
SCHEMBL10035969 0.86 MEN1 (0.73) HSPD1HSPE1MAPTMEN1KMT2A
SCHEMBL5126590 0.84 HSD17B3 (0.72) HSPD1HSPE1MAPTMEN1KMT2A
SCHEMBL5127266 0.84 HSD17B3 (0.72) HSPD1HSPE1MAPTMEN1KMT2A
SCHEMBL17762701 0.83 DUSP22 (0.66) HSPD1HSPE1MAPTMEN1KMT2A
SCHEMBL1421490 0.78 MEN1 (0.68) HSPD1HSPE1MAPTMEN1KMT2A
SCHEMBL1421492 0.78 MEN1 (0.68) HSPD1HSPE1MAPTMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2704578-A2 IMPROVED HONEYBEE REPELLENTS AND USES THEREOF Inscent, Inc. (US) 2014-03-12 EP claimed
WO-2012151556-A2 IMPROVED HONEYBEE REPELLENTS AND USES THEREOF INSCENT, INC. (US) 2012-11-08 WO claimed
US-11963527-B2 Compounds, compositions, and methods for altering insect and organism behavior BASF CORPORATION (US) 2024-04-23 US disclosed
US-20190104732-A1 Compounds, Compositions, and Methods for Altering Insect and Organism Behavior BASF CORPORATION 2019-04-11 US disclosed
US-10098352-B2 Honeybee repellents and uses thereof INSCENT, INC. (US) 2018-10-16 US disclosed
US-20160330960-A1 Honeybee Repellents and Uses Thereof INSCENT, INC. (US) 2016-11-17 US disclosed
US-9439434-B2 Honeybee repellents and uses thereof INSCENT, INC. (US) 2016-09-13 US disclosed
EP-2704578-B1 USE OF HONEYBEE REPELLENTS INSCENT INC (US) 2016-08-31 EP disclosed
EP-3027022-A2 COMPOUNDS, COMPOSITIONS, AND METHODS FOR REPELLING AN INSECT FROM AN AREA, ARTICLE, AND/OR STRUCTURE Bayer CropScience LP (US) 2016-06-08 EP disclosed
US-20160029628-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR REPELLING AN INSECT FROM AN AREA,ARTICLE, AND/OR STRUCTURE BAYER CROPSCIENCE LP (US) 2016-02-04 US disclosed
EP-2967041-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR ALTERING INSECT AND ORGANISM BEHAVIOR Bayer CropScience LP (US) 2016-01-20 EP disclosed
US-20150257384-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR ALTERING INSECT AND ORGANISM BEHAVIOR BASF CORPORATION 2015-09-17 US disclosed
WO-2014146143-A2 COMPOUNDS, COMPOSITIONS, AND METHODS FOR REPELLING AN INSECT FROM AN AREA, ARTICLE, AND/OR STRUCTURE BAYER CROPSCIENCE LP (US) 2014-09-18 WO disclosed
WO-2014146145-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR ALTERING INSECT AND ORGANISM BEHAVIOR BAYER CROPSCIENCE LP (US) 2014-09-18 WO disclosed
US-20140155261-A1 Honeybee Repellents and Uses Thereof INSCENT, INC. (US) 2014-06-05 US disclosed
EP-2704578-A2 IMPROVED HONEYBEE REPELLENTS AND USES THEREOF Inscent, Inc. (US) 2014-03-12 EP disclosed
WO-2012151556-A2 IMPROVED HONEYBEE REPELLENTS AND USES THEREOF INSCENT, INC. (US) 2012-11-08 WO 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 (7 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-20160029628-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR REPELLING AN INSECT FROM AN AREA,ARTICLE, AND/OR STRUCTURE ACHE, BCHE, SGMS1 HSPD1 3918/4885HSPE1 3347/4885MAPT 830/4885
US-20160330960-A1 Honeybee Repellents and Uses Thereof ACHE, AHNAK, L3MBTL3 HSPD1 1105/4885HSPE1 412/4885MAPT 1877/4885
US-10098352-B2 Honeybee repellents and uses thereof ACHE, AHNAK, L3MBTL3 HSPD1 1105/4885HSPE1 412/4885MAPT 1877/4885
US-11963527-B2 Compounds, compositions, and methods for altering insect and organism behavior ACHE, DDT, MGLL HSPD1 322/4885HSPE1 390/4885MAPT 1884/4885
US-20150257384-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR ALTERING INSECT AND ORGANISM BEHAVIOR ACHE, DDT, MGLL HSPD1 322/4885HSPE1 390/4885MAPT 1884/4885
US-20140155261-A1 Honeybee Repellents and Uses Thereof ACHE, AHNAK, L3MBTL3 HSPD1 1105/4885HSPE1 412/4885MAPT 1877/4885
US-20190104732-A1 Compounds, Compositions, and Methods for Altering Insect and Organism Behavior ACHE, DDT, MGLL HSPD1 322/4885HSPE1 390/4885MAPT 1884/4885

“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.