SCHEMBL719617

SCHEMBL719617

O=S(=O)(O)C(C(F)(F)F)(C(F)(F)F)C(F)(F)F

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
TSHR P16473 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
CA5A P35218 1/20 0.33
CA5B Q9Y2D0 1/20 0.33
CA1 P00915 3/20 0.32
CA2 P00918 3/20 0.32
CA7 P43166 1/20 0.32
CA13 Q8N1Q1 1/20 0.32
MMP1 P03956 1/20 0.31
MMP2 P08253 1/20 0.31
MMP9 P14780 1/20 0.31
MMP8 P22894 1/20 0.31
MMP13 P45452 1/20 0.31

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
Fluoride SCHEMBL27898175 0.97 ALDH1A1 (0.41) ALDH1A1L3MBTL1TSHRTDP1CA5A
Ammonia Solution, Strong SCHEMBL9308572 0.97 ALDH1A1 (0.41) ALDH1A1L3MBTL1TSHRTDP1CA5A
Iodide SCHEMBL27881116 0.97 ALDH1A1 (0.41) ALDH1A1L3MBTL1TSHRTDP1CA5A
SCHEMBL1411130 0.97 ALDH1A1 (0.41) ALDH1A1L3MBTL1TSHRTDP1CA5A
SCHEMBL575353 0.86 ALDH1A1 (0.35) ALDH1A1L3MBTL1
1,3-Propanediol SCHEMBL575612 0.84 ATR (0.34) ALDH1A1L3MBTL1
1,4-Butanediol SCHEMBL575857 0.84 ATR (0.34) ALDH1A1L3MBTL1
Hydroquinone SCHEMBL575690 0.82 LMNA (0.46) ALDH1A1L3MBTL1CA5ACA5BCA1
SCHEMBL16353512 0.80 ALDH1A1 (0.39) ALDH1A1L3MBTL1TSHRTDP1CA1
Propylene Glycol SCHEMBL575465 0.80 TDP1 (0.46) ALDH1A1L3MBTL1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8623948-B2 Polycarbonate compositions having antistatic enhancers, method of preparing, and articles comprising the same SABIC INNOVATIVE PLASTICS IP B.V. (NL) 2014-01-07 US claimed
EP-1899289-B1 METHOD FOR PRODUCING ARYL AMINES, ARYL ETHERS AND ARYL THIOETHERS ARCHIMICA GMBH (DE) 2011-08-10 EP claimed
US-20090326116-A1 POLYCARBONATE COMPOSITIONS HAVING ANTISTATIC ENHANCERS, METHOD OF PREPARING, AND ARTICLES COMPRISING THE SAME SABIC GLOBAL TECHNOLOGIES B.V. (NL) 2009-12-31 US claimed
US-20090143586-A1 Method for producing alkyl-substituted aromatic and heteroaromatic compounds by cross-coupling alkyl boronic acids with aryl-or heteroaryl-halogenides or sulfonates under Pd catalysis in the presence of a ligand ARCHIMICA GMBH (DE) 2009-06-04 US claimed
EP-1861343-B1 METHOD FOR PRODUCING ALKYL-SUBSTITUTED AROMATIC AND HETEROAROMATIC COMPOUNDS BY CROSS-COUPLING ALKYL BORONIC ACIDS WITH ARYL- OR HETEROARYL-HALOGENIDES OR SULFONATES UNDER PD CATALYSIS IN THE PRESENCE OF A LIGAND ARCHIMICA GMBH (DE) 2009-03-04 EP claimed
US-20080306260-A1 Method for Producing Aryl Amines, Aryl Ethers and Aryl Thioethers ARCHIMICA GMBH (DE) 2008-12-11 US claimed
JP-2008543960-A 2008-12-04 JP claimed
EP-1903023-A1 Method for manufacturing arylamines Archimica GmbH (DE) 2008-03-26 EP claimed
EP-1899289-A1 METHOD FOR PRODUCING ARYL AMINES, ARYL ETHERS AND ARYL THIOETHERS Archimica GmbH (DE) 2008-03-19 EP claimed
US-20080039633-A1 Process for preparing arylamines ARCHIMICA GMBH (DE) 2008-02-14 US claimed
WO-2007000250-A1 METHOD FOR PRODUCING ARYL AMINES, ARYL ETHERS AND ARYL THIOETHERS ARCHIMICA GMBH (DE) 2007-01-04 WO claimed
CN-119371719-A Resin additive composition, thermoplastic resin composition, and molded article thereof 株式会社ADEKA 2025-01-28 CN disclosed
CN-118974208-A Flame retardant composition, flame-retardant resin composition, and molded article 株式会社ADEKA 2024-11-15 CN disclosed
CN-118159625-A Flame retardant composition, flame retardant resin composition, and molded article 株式会社ADEKA 2024-06-07 CN disclosed
CN-114621154-B Adduct and preparation method thereof, flame retardant composition and application 金发科技股份有限公司 2024-06-04 CN disclosed
US-20030203810-A1 Catalyst component for addition polymerization, catalyst for addition polymerization, and process for producing addition polymer SUMITOMO CHEMICAL COMPANY, LIMITED 2003-10-30 US disclosed
US-6586356-B2 Coordination catalyst SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2003-07-01 US disclosed
US-20010020075-A1 Catalyst component for addition polymerization, catalyst for addition polymerization, and process for producing addition polymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-09-06 US disclosed
EP-1113026-A2 Catalyst component for addition polymerization, catalyst for addition polymerization, and process for producing addition polymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-07-04 EP disclosed
US-4692555-A Preparation of diphenolics ETHYL CORPORATION (US) 1987-09-08 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-20090143586-A1 Method for producing alkyl-substituted aromatic and heteroaromatic compounds by cross-coupling alkyl boronic acids with aryl-or heteroaryl-halogenides or sulfonates under Pd catalysis in the presence of a ligand AHR, BRS3, ARSA ALDH1A1 2005/4885L3MBTL1 3284/4885TSHR 387/4885
US-20080039633-A1 Process for preparing arylamines BRD4, AHR, BRD1 ALDH1A1 581/4885L3MBTL1 2679/4885TSHR 2168/4885
US-20080306260-A1 Method for Producing Aryl Amines, Aryl Ethers and Aryl Thioethers TST, TAAR1, TSHR ALDH1A1 1524/4885L3MBTL1 3332/4885TSHR 3/4885

“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.