SCHEMBL2005442

SCHEMBL2005442

Fc1cc(C(F)(F)F)cc(F)c1F

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 2/20 0.40
PDE2A O00408 3/20 0.39
IDO1 P14902 4/20 0.38
CES1 P23141 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
TSHR P16473 3/20 0.36
ALDH1A1 P00352 2/20 0.36
CYP3A4 P08684 1/20 0.33
HPGD P15428 1/20 0.33
ALOX15 P16050 1/20 0.33
HIF1A Q16665 1/20 0.33
TXNRD1 Q16881 1/20 0.33
TXNRD3 Q86VQ6 1/20 0.33
TXNRD2 Q9NNW7 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
MAPK1 P28482 1/20 0.33
MPL P40238 1/20 0.33
APP P05067 1/20 0.32
GPR35 Q9HC97 1/20 0.32

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
SCHEMBL12912376 0.84 RAPGEF4 (0.39) CES2PDE2AIDO1MEN1KMT2A
SCHEMBL13326020 0.82 PDE2A (0.33) CES2PDE2AIDO1MEN1KMT2A
SCHEMBL9465131 0.82 PTPN5 (0.44) CES2PDE2AIDO1MEN1KMT2A
SCHEMBL1531168 0.82 PDE2A (0.37) CES2PDE2ATSHRALDH1A1CYP3A4
SCHEMBL543287 0.82 PDE2A (0.33) CES2PDE2AIDO1
SCHEMBL11039041 0.82 PDE2A (0.33) CES2PDE2AIDO1
SCHEMBL15850519 0.79 CES2 (0.39) CES2PDE2AIDO1TSHRALDH1A1
SCHEMBL29937091 0.78 ALOX5AP (0.37) CES2PDE2AIDO1
SCHEMBL20817217 0.78 CES2 (0.35) CES2IDO1
SCHEMBL27494719 0.78 PDE2A (0.32) CES2PDE2AIDO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7371861-B2 Process for preparing ring-fluorinated aromatics LANXESS DEUTSCHLAND GMBH (DE) 2008-05-13 US claimed
EP-1616863-A1 Process for the preparation of fluorinated aromatic compounds LANXESS Deutschland GmbH (DE) 2006-01-18 EP claimed
US-20060009643-A1 Process for preparing ring-fluorinated aromatics LANXESS DEUTSCHLAND GMBH (DE) 2006-01-12 US claimed
EP-0034402-B1 METHOD OF PREPARING FLUORINE-SUBSTITUTED DIPHENYL ETHER DERIVATIVES AND FLUORINE-SUBSTITUTED HALOGENO BENZENE DERIVATIVES FOR USE THEREIN IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1984-08-29 EP claimed
US-4384135-A REACTING A SUBSTITUTED BENZOTRIFLUORIDE WITH A SUBSTITUTED PHENOL IMPERIAL CHEMICAL INDUSTRIES LIMITED (GB) 1983-05-17 US claimed
EP-0034402-A2 Method of preparing fluorine-substituted diphenyl ether derivatives and fluorine-substituted halogeno benzene derivatives for use therein IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1981-08-26 EP claimed
JP-62289534-A None JP disclosed
JP-1246232-A None JP disclosed
JP-5238985-A None JP disclosed
WO-2026106260-A1 NOVEL DIPHENYLETHER DERIVATIVE AND USE THEREOF 광주과학기술원 2026-05-21 WO disclosed
CN-119241408-A Trifluoro methyl sulfide molecule as HIF2a inhibitor 维眸生物科技(浙江)有限公司 2025-01-03 CN disclosed
US-11548854-B2 Heterocyclic compounds as pesticides BAYER CROPSCIENCE AG (DE) 2023-01-10 US disclosed
US-11332448-B2 Heterocyclic compounds as pesticides BAYER CROPSCIENCE AG (DE) 2022-05-17 US disclosed
EP-0180057-A1 Process for the preparation of halo aromatic compounds OCCIDENTAL CHEMICAL CORPORATION (US) 1986-05-07 EP disclosed
EP-0034402-B1 METHOD OF PREPARING FLUORINE-SUBSTITUTED DIPHENYL ETHER DERIVATIVES AND FLUORINE-SUBSTITUTED HALOGENO BENZENE DERIVATIVES FOR USE THEREIN IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1984-08-29 EP disclosed
US-4388472-A Substituted diphenyl ethers IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1983-06-14 US disclosed
US-4384135-A REACTING A SUBSTITUTED BENZOTRIFLUORIDE WITH A SUBSTITUTED PHENOL IMPERIAL CHEMICAL INDUSTRIES LIMITED (GB) 1983-05-17 US disclosed
EP-0023100-B1 HERBICIDAL COMPOSITIONS COMPRISING A DIPHENYL ETHER COMPOUND IN ADMIXTURE WITH ANOTHER HERBICIDE IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1982-11-10 EP disclosed
EP-0034402-A2 Method of preparing fluorine-substituted diphenyl ether derivatives and fluorine-substituted halogeno benzene derivatives for use therein IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1981-08-26 EP disclosed
EP-0023100-A1 Herbicidal compositions comprising a diphenyl ether compound in admixture with another herbicide IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1981-01-28 EP 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-20060009643-A1 Process for preparing ring-fluorinated aromatics FLI1, CYP4X1, AFF1 CES2 1285/4885PDE2A 4829/4885IDO1 2060/4885
US-11548854-B2 Heterocyclic compounds as pesticides DDT, ACHE, PTMS CES2 753/4885PDE2A 712/4885IDO1 1350/4885
US-11332448-B2 Heterocyclic compounds as pesticides DDT, ACHE, PTMS CES2 753/4885PDE2A 712/4885IDO1 1350/4885

“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.