SCHEMBL203839

SCHEMBL203839

O=C/C=C(\Br)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 4/20 0.44
ALDH1A1 P00352 3/20 0.44
MAPK1 P28482 2/20 0.44
CES1 P23141 5/20 0.40
CES2 O00748 4/20 0.40
TSHR P16473 2/20 0.40
DAO P14920 1/20 0.40
NAPRT Q6XQN6 1/20 0.40
AKT1 P31749 1/20 0.38
PTPN1 P18031 1/20 0.38
GSK3B P49841 1/20 0.38
CA2 P00918 3/20 0.37
CA12 O43570 3/20 0.37
CA1 P00915 3/20 0.37
CA9 Q16790 3/20 0.37
CYP3A4 P08684 2/20 0.37
MAPT P10636 2/20 0.37
CA4 P22748 2/20 0.37
HSD17B10 Q99714 2/20 0.37
L3MBTL1 Q9Y468 2/20 0.37

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
SCHEMBL203840 1.00 TDP1 (0.44) TDP1ALDH1A1MAPK1CES1CES2
Methyl Alcohol SCHEMBL28258077 0.96 ALDH1A1 (0.41) TDP1ALDH1A1MAPK1CES1CES2
SCHEMBL18690045 0.88 MEN1 (0.39) TDP1ALDH1A1MAPK1CES1CES2
SCHEMBL6711126 0.87 PTPN1 (0.46) TDP1ALDH1A1MAPK1PTPN1GSK3B
SCHEMBL28615013 0.79 CES2 (0.46) ALDH1A1MAPK1CES1CES2GSK3B
SCHEMBL28603750 0.77 CES2 (0.44) CES1CES2PTPN1CA2CA1
SCHEMBL28615101 0.77 ALDH1A1 (0.45) TDP1ALDH1A1CES1CES2GSK3B
SCHEMBL28619042 0.77 CES2 (0.44) ALDH1A1MAPK1CES1CES2TSHR
SCHEMBL28472161 0.77 CES2 (0.44) ALDH1A1MAPK1CES1CES2TSHR
SCHEMBL2831280 0.76 AKT1 (0.43) TDP1ALDH1A1MAPK1CES1CES2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115677627-B 2,2' -bisfuran compound, and preparation method and application thereof 华南理工大学 2024-04-12 CN disclosed
US-11723368-B2 Penflufen as a wood preservative against wood-destroying basidiomycetes LANHESS Deutshcland GmbH 2023-08-15 US disclosed
CN-115677627-A 2,2' -difuran compound and preparation method and application thereof 华南理工大学 2023-02-03 CN disclosed
US-11566140-B2 Exterior coating composition TROY CORPORATION (US) 2023-01-31 US disclosed
CN-113214283-B Preparation method of furan macrocyclic compound, prepared furan macrocyclic compound and application 华南理工大学 2022-09-30 CN disclosed
CN-113873886-A Overcoat compositions 特洛伊公司 2021-12-31 CN disclosed
CN-113214283-A Preparation method of furan macrocyclic compound, prepared furan macrocyclic compound and application 华南理工大学 2021-08-06 CN disclosed
CN-108077275-B Fungicidal penflufen mixtures 朗盛德国有限责任公司 2021-04-30 CN disclosed
WO-2020243293-A1 EXTERIOR COATING COMPOSITION TROY CORPORATION (US) 2020-12-03 WO disclosed
US-20200377738-A1 EXTERIOR COATING COMPOSITION TROY CORPORATION (US) 2020-12-03 US disclosed
CN-1234058-A Antifouling paint BAYER AG (DE) 1999-11-03 CN disclosed
CN-1234059-A Antifouling paints BAYER AG (DE) 1999-11-03 CN disclosed
US-5925675-A N-sulfonyliminodithio compounds useful for in plant and material protection BAYER AKTIENGESELLSCHAFT (DE) 1999-07-20 US disclosed
US-5874025-A Timber preservative containing a copper compound BAYER AKTIENGESELLSCHAFT (DE) 1999-02-23 US disclosed
CN-1206333-A Synergistic insecticidal composition BAYER AG (DE) 1999-01-27 CN disclosed
US-5767137-A FOR INDUSTRIAL MATERIALS BAYER AKTIENGESELLSCHAFT (DE) 1998-06-16 US disclosed
US-5703103-A MICROBIOCIDES BAYER AKTIENGESELLSCHAFT (DE) 1997-12-30 US disclosed
US-5672617-A Medicaments containing 1-thiocarbamoyl-5-hydroxy-pyrazoles and their use as agents for combating septic shock BAYER AKTIENGESELLSCHAFT (DE) 1997-09-30 US disclosed
US-5622546-A Mould-resistant emulsion paints BAYER AKTIENGESELLSCHAFT (DE) 1997-04-22 US disclosed
CN-1128993-A Medicaments containing thiocarbamoyl-5-hydroxy pyrazoles BAYER AG (DE) 1996-08-14 CN 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-11723368-B2 Penflufen as a wood preservative against wood-destroying basidiomycetes BLVRB, DCXR, PAH TDP1 2244/4885ALDH1A1 199/4885MAPK1 2757/4885

“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.