SCHEMBL2575338

SCHEMBL2575338

CC1=C(C)C(=O)C(Cl)=C(Cl)C1=O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES1 P23141 5/20 0.57
KDM4E B2RXH2 3/20 0.57
MAPT P10636 3/20 0.57
CES2 O00748 2/20 0.57
BCHE P06276 2/20 0.57
ACHE P22303 2/20 0.57
HPGD P15428 2/20 0.57
ALOX15 P16050 2/20 0.57
MAPK1 P28482 2/20 0.57
HSD17B10 Q99714 2/20 0.57
MEN1 O00255 2/20 0.57
ALDH1A1 P00352 2/20 0.57
KMT2A Q03164 2/20 0.57
TP53 P04637 1/20 0.57
CYP3A4 P08684 1/20 0.57
TSHR P16473 1/20 0.57
ALOX12 P18054 1/20 0.57
RECQL P46063 1/20 0.57
HIF1A Q16665 1/20 0.57
TDP1 Q9NUW8 1/20 0.57

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
SCHEMBL12465570 0.86 CES2 (0.41) CES1KDM4EMAPTCES2BCHE
SCHEMBL7896994 0.86 CES2 (0.60) CES1KDM4EMAPTCES2BCHE
SCHEMBL1392670 0.85 CES1 (0.47) CES1KDM4EMAPTCES2BCHE
SCHEMBL13928084 0.83 CES2 (0.53) CES1KDM4EMAPTCES2BCHE
SCHEMBL13928036 0.79 CES2 (0.56) CES1KDM4EMAPTCES2BCHE
SCHEMBL5588953 0.77 KDM4E (0.47) CES1KDM4EMAPTCES2BCHE
SCHEMBL20867386 0.77 CES2 (0.53) CES1KDM4EMAPTCES2BCHE
SCHEMBL19398342 0.76 CES2 (0.62) CES1KDM4EMAPTCES2BCHE
SCHEMBL9061250 0.74 MAPT (0.52) CES1KDM4EMAPTCES2BCHE
SCHEMBL13453022 0.74 CES2 (0.53) CES1KDM4EMAPTCES2BCHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105080423-A Quaternary ammonium salt type Gemini surfactant and preparation method therefor UNIV EAST CHINA SCIENCE & TECH 2015-11-25 CN claimed
CN-103787849-A Novel method for preparing cinnoline derivative midbody dichloro dimethyl benzoquinone Hunan huateng pharmaceutical co ltd 2014-05-14 CN claimed
WO-2023215514-A2 BIOLUMINESCENCE-TRIGGERED PHOTOCATALYTIC LABELING PROMEGA CORPORATION (US) 2023-11-09 WO disclosed
US-20230352726-A1 SOLID STATE BIPOLAR BATTERY IONIC MATERIALS, INC. 2023-11-02 US disclosed
US-11749833-B2 Solid state bipolar battery IONIC MATERIALS, INC. (US) 2023-09-05 US disclosed
US-11319411-B2 Solid ionically conducting polymer material IONIC MATERIALS, INC. (US) 2022-05-03 US disclosed
US-11251455-B2 Solid ionically conducting polymer material IONIC MATERIALS, INC. (US) 2022-02-15 US disclosed
EP-3945363-A1 ELECTROCHROMIC ELEMENT, AND METHOD FOR DRIVING THE SAME Ricoh Company, Ltd. (JP) 2022-02-02 EP disclosed
WO-2021046533-A1 ORGANIC POLYMERIC COMPOSITIONS ARNOLD MICHAEL JOHN (US) 2021-03-11 WO disclosed
US-20200358107-A9 SOLID IONICALLY CONDUCTING POLYMER MATERIAL IONIC MATERIALS, INC. 2020-11-12 US disclosed
CN-111556865-A Polycyclic compound and organic electronic device comprising same 株式会社LG化学 2020-08-18 CN disclosed
EP-2703397-A1 DITHIIN DERIVATIVES AS FUNGICIDES Bayer Intellectual Property GmbH (DE) 2014-03-05 EP disclosed
US-20130296315-A1 Use of Dithiine Derivatives in Crop Protection and the Protection of Materials BAYER CROPSCIENCE AG (DE) 2013-11-07 US disclosed
EP-2558456-A1 DITHIIN DERIVATIVES AS FUNGICIDES Bayer Intellectual Property GmbH (DE) 2013-02-20 EP disclosed
US-20110294662-A1 Use of Dithiine Derivatives in Crop Protection and the Protection of Materials BAYER CROPSCIENCE AG (DE) 2011-12-01 US disclosed
WO-2011128301-A1 DITHIIN DERIVATIVES AS FUNGICIDES BAYER CROPSCIENCE AG (DE) 2011-10-20 WO disclosed
US-7977491-B2 reacting with ketone compound in presence of solvent FUJIFILM CORPORATION (JP) 2011-07-12 US disclosed
US-7977491-B2 reacting with ketone compound in presence of solvent FUJIFILM CORPORATION (JP) 2011-07-12 US disclosed
US-5126802-A Electric device RICOH COMPANY, LTD. (JP) 1992-06-30 US disclosed
US-5006915-A Electric device and photoelectric conversion device comprising the same RICOH COMPANY, LTD. (JP) 1991-04-09 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 (2 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-20130296315-A1 Use of Dithiine Derivatives in Crop Protection and the Protection of Materials DDT, TST, TXN CES1 2447/4885KDM4E 1878/4885MAPT 1378/4885
US-20110294662-A1 Use of Dithiine Derivatives in Crop Protection and the Protection of Materials DDT, TST, TXN CES1 2447/4885KDM4E 1878/4885MAPT 1378/4885

“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.