SCHEMBL548634

SCHEMBL548634

O=CC(C=O)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.48
SRC P12931 2/20 0.42
DPP4 P27487 2/20 0.41
F2 P00734 1/20 0.41
TSHR P16473 1/20 0.41
ALDH1A1 P00352 1/20 0.41
CYP2A6 P11509 1/20 0.41
LMNA P02545 2/20 0.40
MAPK1 P28482 1/20 0.40
KMT2A Q03164 1/20 0.39
CES2 O00748 1/20 0.39
CES1 P23141 1/20 0.39
HTR2A P28223 1/20 0.38
TAAR1 Q96RJ0 1/20 0.38

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
SCHEMBL5243253 0.97 CYP2D6 (0.46) CYP2D6SRCDPP4F2TSHR
SCHEMBL1335929 0.85 CYP2D6 (0.41) CYP2D6SRCDPP4F2TSHR
SCHEMBL2554928 0.85 ACP3 (0.47) ALDH1A1MAPK1TAAR1
SCHEMBL11470444 0.85 CYP2D6 (0.41) CYP2D6SRCDPP4F2TSHR
SCHEMBL7995901 0.81 CYP2D6 (0.38) CYP2D6SRCDPP4F2LMNA
SCHEMBL7995898 0.81 CYP2D6 (0.38) CYP2D6SRCDPP4F2LMNA
SCHEMBL1579572 0.79 CYP1A2 (0.53) CYP2D6ALDH1A1CYP2A6LMNAMAPK1
SCHEMBL3278200 0.79 CYP2D6 (0.41) CYP2D6SRCTSHRALDH1A1LMNA
SCHEMBL15572433 0.79 CYP1A2 (0.53) CYP2D6ALDH1A1CYP2A6LMNAMAPK1
SCHEMBL4432460 0.77 CYP2D6 (0.48) CYP2D6SRCDPP4F2TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12612523-B2 Fireproof coating material WeiFang Jia Cheng Digital Materials Co., Ltd. (CN) 2026-04-28 US claimed
US-20240343921-A1 FIREPROOF COATING MATERIAL WeiFang Jia Cheng Digital Materials Co., Ltd. (CN) 2024-10-17 US claimed
CN-117467379-B Preparation method of organic-inorganic composite self-cleaning supermolecule modified acrylic ester seam beautifying agent 东莞市亮舍建材有限公司 2024-08-20 CN claimed
EP-4335909-A1 FIRE-RESISTANT COATING MATERIAL Weifang Jia Cheng Digital Materials Co., Ltd. (CN) 2024-03-13 EP claimed
WO-2024021366-A1 FIRE-RESISTANT COATING MATERIAL 潍坊佳诚数码材料有限公司 2024-02-01 WO claimed
CN-117467379-A Preparation method of organic-inorganic composite self-cleaning supermolecule modified acrylic ester seam beautifying agent 东莞市亮舍建材有限公司 2024-01-30 CN claimed
CN-112552473-B Thermosetting resin, preparation method and application thereof in fiber reinforced composite material 万华化学集团股份有限公司 2022-11-04 CN claimed
CN-115074012-A Fireproof coating material 潍坊佳诚数码材料有限公司 2022-09-20 CN claimed
CN-112552473-A Thermosetting resin, preparation method and application thereof in fiber reinforced composite material 万华化学集团股份有限公司 2021-03-26 CN claimed
EP-2808736-B1 Compound for resist and radiation-sensitive composition MITSUBISHI GAS CHEMICAL CO (JP) 2018-07-18 EP claimed
CN-1675997-A Alpha-hydroxy sulfonate aldehydes, germicidal compositions and disinfection or sterilization method ETHICON INC (US) 2005-10-05 CN claimed
CN-1666610-A Germicidal compositions and methods of using such compositions for disinfection or sterilization ETHICON INC (US) 2005-09-14 CN claimed
EP-1561478-A1 Germicidal compositions containing phenylmalonaldehyde-type compounds and methods of using such compositions for disinfection or sterilization ETHICON, INC. (US) 2005-08-10 EP claimed
EP-1561474-A1 Alpha-hydroxy sulfonate aldehydes, germicidal compositions containing the alpha-hydroxy sulfonate aldehydes, or mixtures of alpha-hydroxy sulfonate aldehydes and phthalaldehydes, and methods of using the compounds of compositions for disinfection or sterilization Ethicon, Inc. (US) 2005-08-10 EP claimed
US-20050171216-A1 Germicidal compositions containing phthalaldehyde mixtures and methods of using such compositions for disinfection or sterilization ETHICON, INC. 2005-08-04 US claimed
US-20050171121-A1 Germicidal compositions containing phenylmalonaldehyde-type compounds, or mixtures of phenylmalonaldehyde-type compounds and phthalaldehydes, and methods of using such compositions for disinfection or sterilization ETHICON, INC. 2005-08-04 US claimed
US-20050171201-A1 Alpha-hydroxy sulfonate aldehydes, germicidal compositions containing the alpha-hydroxy sulfonate aldehydes, or mixtures of alpha-hydroxy sulfonate aldehydes and phthalaldehydes, and methods of using the compounds or compositions for disinfection or sterilization ETHICON, INC. 2005-08-04 US claimed
EP-1559435-A1 Germicidal compositions containing phthalaldehyde mixtures and methods of using such compositions for disinfection or sterilization Ethicon, Inc. (US) 2005-08-03 EP claimed
CN-1647633-A Germicidal compositions containing phthalaldehyde mixtures and methods of using such compositions for disinfection or sterilization ETHICON INC (US) 2005-08-03 CN claimed
US-4982016-A REDUCTION CARTER-WALLACE, INC. (US) 1991-01-01 US claimed

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

For each of this compound's patents that has machine-readable text (4 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-20050171216-A1 Germicidal compositions containing phthalaldehyde mixtures and methods of using such compositions for disinfection or sterilization ALPG, DDT, DHODH CYP2D6 760/4885SRC 4124/4885DPP4 1429/4885
US-20050171201-A1 Alpha-hydroxy sulfonate aldehydes, germicidal compositions containing the alpha-hydroxy sulfonate aldehydes, or mixtures of alpha-hydroxy sulfonate aldehydes and phthalaldehydes, and methods of using the compounds or compositions for disinfection or sterilization TST, STS, BPNT1 CYP2D6 1678/4885SRC 1486/4885DPP4 2622/4885
US-12612523-B2 Fireproof coating material RFC5, CA3, RFC2 CYP2D6 1393/4885SRC 3774/4885DPP4 4734/4885
US-20050171121-A1 Germicidal compositions containing phenylmalonaldehyde-type compounds, or mixtures of phenylmalonaldehyde-type compounds and phthalaldehydes, and methods of using such compositions for disinfection or sterilization APEH, ALPG, DDT CYP2D6 221/4885SRC 4511/4885DPP4 611/4885

“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.