SCHEMBL186842

SCHEMBL186842

Oc1cc(C(F)(F)F)cc(C(F)(F)F)c1

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 1/20 0.52
GABRB2 P47870 1/20 0.52
CES2 O00748 1/20 0.52
PTGS1 P23219 3/20 0.46
IDO1 P14902 2/20 0.46
KIF11 P52732 1/20 0.46
BACE1 P56817 1/20 0.41
GAA P10253 1/20 0.41
P2RX1 P51575 3/20 0.40
MAPT P10636 1/20 0.40
ITGB3 P05106 1/20 0.40
ITGAV P06756 1/20 0.40
RXRA P19793 1/20 0.40
RXRB P28702 1/20 0.40
RXRG P48443 1/20 0.40
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA9 Q16790 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
SCHEMBL29886876 0.97 CES2 (0.56) GABRA1GABRB2CES2PTGS1IDO1
Water SCHEMBL21493255 0.97 GABRA1 (0.50) GABRA1GABRB2CES2PTGS1IDO1
SCHEMBL29005991 0.97 GABRA1 (0.50) GABRA1GABRB2CES2PTGS1IDO1
SCHEMBL29384937 0.97 GABRA1 (0.50) GABRA1GABRB2CES2PTGS1IDO1
SCHEMBL29170632 0.94 CES2 (0.48) GABRA1GABRB2CES2PTGS1IDO1
SCHEMBL69029 0.94 PTGS1 (0.52) GABRA1GABRB2CES2PTGS1IDO1
SCHEMBL27436296 0.89 CES2 (0.44) GABRA1GABRB2CES2PTGS1IDO1
SCHEMBL17048684 0.87 GABRA1 (0.54) GABRA1GABRB2CES2PTGS1IDO1
SCHEMBL18353568 0.87 GABRA1 (0.76) GABRA1GABRB2CES2PTGS1IDO1
Cyanate SCHEMBL30681205 0.87 CES2 (0.43) GABRA1GABRB2CES2PTGS1IDO1

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 1040 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3842468-B1 LIQUID CRYSTAL POLYESTER RESIN FOR LAMINATE, LIQUID CRYSTAL POLYESTER RESIN COMPOSITION, LAMINATE, AND LIQUID CRYSTAL POLYESTER RESIN FILM TORAY INDUSTRIES (JP) 2025-10-15 EP claimed
US-12410138-B2 Process comprising the use of new iridium catalysts for enantioselective hydrogenation of 4-substituted 1,2-dihydroquinolines BAYER AKTIENGESELLSCHAFT (DE) 2025-09-09 US claimed
CN-120157864-A Multi-center metalloporphyrin complex and application thereof in preparing polycarbonate through catalysis 烟台大学 2025-06-17 CN claimed
CN-120024103-A Transparent polycarbonate composite board with high flame retardance, high weather resistance and self-cleaning function and preparation method thereof 上海品诚控股集团有限公司 2025-05-23 CN claimed
CN-119804835-A Static color development testing method for thermosensitive paper 沈阳感光化工研究院有限公司 2025-04-11 CN claimed
CN-119798271-A Fluorine-containing fluorane compound, light-resistant thermosensitive dye, preparation method and application 沈阳感光化工研究院有限公司 2025-04-11 CN claimed
CN-119592003-A Low-dielectric high-flame-retardance cable material and preparation method and application thereof 宁波聚泰新材料科技有限公司 2025-03-11 CN claimed
CN-119409731-A Binuclear alkali metal complex and preparation method and application thereof 中山大学 2025-02-11 CN claimed
WO-2025021733-A1 ENANTIOSELECTIVE HYDROGENATION OF 4-SUBSTITUTED 1,2-DIHYDROQUINOLINES IN THE PRESENCE OF A CHIRAL IRIDIUM (P,S)-LIGAND CATALYST BAYER AKTIENGESELLSCHAFT (DE) 2025-01-30 WO claimed
CN-119264394-A Method for preparing polyhydroxyalkanoate copolymer by catalyzing cyclopropylium salt catalyst 浙江大学 2025-01-07 CN claimed
EP-1465869-A4 MODULATORS OF LXR X CEPTOR THERAPEUTICS INC (US) 2005-12-28 EP claimed
JP-2005536450-A 2005-12-02 JP claimed
CN-1560111-A Preparation process of polyester carbonate with high molecular weight whole alternant structure 大连理工大学 2005-01-05 CN claimed
EP-1465869-A1 MODULATORS OF LXR X-Ceptor Therapeutics, Inc. (US) 2004-10-13 EP claimed
US-20030181420-A1 Heterocyclic compounds, in particular N-substituted pyridones for modulating the activity of nuclear receptors EXELIXIS, INC. 2003-09-25 US claimed
WO-2003059884-A1 MODULATORS OF LXR X-CEPTOR THERAPEUTICS, INC. (US) 2003-07-24 WO claimed
US-4960539-A Use of fluoromethylphenols as solvents for LC-polymers, and new fluoromethylphenols BAYER AKTIENGESELLSCHAFT (DE) 1990-10-02 US claimed
EP-0286953-B1 USE OF FLUOROMETHYL PHENOLS AS SOLVENTS FOR LC POLYMERS, AND FLUOROMETHYL PHENOLS BAYER AG (DE) 1990-09-26 EP claimed
EP-0088066-B1 3,5-BIS (TRIFLUOROMETHYL) PHENOXY CARBOXYLIC ACIDS AND DERIVATIVES THEREOF MONSANTO COMPANY (US) 1985-04-03 EP claimed
EP-0088066-A1 3,5-Bis (trifluoromethyl) phenoxy carboxylic acids and derivatives thereof MONSANTO COMPANY (US) 1983-09-07 EP 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 (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-20030181420-A1 Heterocyclic compounds, in particular N-substituted pyridones for modulating the activity of nuclear receptors NR1H2, NR1H3, NCOA1 GABRA1 534/4885GABRB2 749/4885CES2 1566/4885
US-12410138-B2 Process comprising the use of new iridium catalysts for enantioselective hydrogenation of 4-substituted 1,2-dihydroquinolines HVCN1, HDHD5, HRH4 GABRA1 3037/4885GABRB2 2404/4885CES2 3681/4885

“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.