SCHEMBL12339111

SCHEMBL12339111

CC(c1ccccc1)(C(F)(F)F)C(F)(F)F

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.52
TSHR P16473 2/20 0.52
MAPK1 P28482 1/20 0.46
TAAR1 Q96RJ0 1/20 0.42
ALOX15 P16050 1/20 0.42
ESR1 P03372 2/20 0.41
ESR2 Q92731 2/20 0.41
PTPN1 P18031 1/20 0.41
CYP3A4 P08684 1/20 0.41
KCNN4 O15554 3/20 0.40
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA5A P35218 1/20 0.39
CA9 Q16790 1/20 0.39
MAPT P10636 1/20 0.39
KMT2A Q03164 1/20 0.39
KIF11 P52732 1/20 0.39
HSD11B1 P28845 1/20 0.38
CYP2C19 P33261 1/20 0.38
HIF1A Q16665 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
SCHEMBL16682492 0.90 ALDH1A1 (0.48) ALDH1A1TSHRMAPK1TAAR1ALOX15
SCHEMBL14189003 0.85 KIF11 (0.60) ALDH1A1TSHRMAPK1TAAR1PTPN1
SCHEMBL17232307 0.85 NR1I2 (0.40) TSHRESR1ESR2CYP3A4KIF11
SCHEMBL17232308 0.81 TSHR (0.44) ALDH1A1TSHRMAPK1TAAR1ESR1
SCHEMBL14188999 0.80 LTA4H (0.48) ALDH1A1TSHRMAPK1ESR2CA1
SCHEMBL4600929 0.78 ALDH1A1 (0.52) ALDH1A1TSHRMAPK1TAAR1ALOX15
SCHEMBL20002043 0.78 ALDH1A1 (0.52) ALDH1A1TSHRMAPK1TAAR1ALOX15
SCHEMBL21846673 0.78 TSHR (0.50) ALDH1A1TSHRMAPK1ALOX15MAPT
SCHEMBL13025956 0.78 KIF11 (0.44) KIF11NR1H2NR1H3
SCHEMBL5079313 0.78 ALDH1A1 (0.52) ALDH1A1TSHRMAPK1TAAR1ALOX15

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 18 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11213550-B2 Cell preparation for treating cartilage tissue-related disorder NIPPON SHOKUBAI CO., LTD. (JP) 2022-01-04 US disclosed
US-20190307807-A1 CELL PREPARATION NIPPON SHOKUBAI CO., LTD. (JP) 2019-10-10 US disclosed
US-8815453-B1 Flame retardant battery QUALLION LLC (US) 2014-08-26 US disclosed
US-8268531-B2 Photoacid generator compounds and compositions CORNELL RESEARCH FOUNDATION, INC. (US) 2012-09-18 US disclosed
US-8268531-B2 Photoacid generator compounds and compositions CORNELL RESEARCH FOUNDATION, INC. (US) 2012-09-18 US disclosed
US-20110008732-A1 PHOTOACID GENERATOR COMPOUNDS AND COMPOSITIONS CORNELL RESEARCH FOUNDATION, INC. (US) 2011-01-13 US disclosed
US-20110008732-A1 PHOTOACID GENERATOR COMPOUNDS AND COMPOSITIONS CORNELL RESEARCH FOUNDATION, INC. (US) 2011-01-13 US disclosed
US-7824839-B2 cationic lactone containing perfluorinated sulfonate or sulfonimides with iodonium or sulfonium anions as photoacid generator, a polyhydroxystyrene homo or copolymer and a solvent (propylene glycol/1,2-/, monoalkyl ether, ethyl lactone ); semiconductor, heat exposure, pattern forming; development CORNELL RESEARCH FOUNDATION, INC. (US) 2010-11-02 US disclosed
US-20090136868-A1 PHOTOACID GENERATOR COMPOUNDS AND COMPOSITIONS CORNELL RESEARCH FOUNDATION, INC. 2009-05-28 US disclosed
US-20090136868-A1 PHOTOACID GENERATOR COMPOUNDS AND COMPOSITIONS CORNELL RESEARCH FOUNDATION, INC. 2009-05-28 US disclosed
US-7378154-B2 Radiation transparent glass, polycarbonate, polyethylene terephthalate, acrylic, methyl cellulose or polycycloolefin substrate, a fluoropolymer layer containing and a rare earth metal compound, and a low refractive index layer; fluorescence; light amplification; improved efficiency; light emitting diodes DAIKIN INDUSTRIES, LTD. (JP) 2008-05-27 US disclosed
US-7345135-B2 Crosslinkable aromatic resin having protonic acid group, and ion conductive polymer membrane, binder and fuel cell using the resin MITSUI CHEMICALS, INC. (JP) 2008-03-18 US disclosed
US-7345135-B2 Crosslinkable aromatic resin having protonic acid group, and ion conductive polymer membrane, binder and fuel cell using the resin MITSUI CHEMICALS, INC. (JP) 2008-03-18 US disclosed
WO-2007124092-A2 PHOTOACID GENERATOR COMPOUNDS AND COMPOSITIONS CORNELL RESEARCH FOUNDATION, INC. (US) 2007-11-01 WO disclosed
US-20070218289-A1 Photofunctional Laminated Article DAIKIN INDUSTRIES, LTD. (JP) 2007-09-20 US disclosed
US-20070179263-A1 Functional material comprising fluorine-containing compound DAIKIN INDUSTRIES LTD. (JP) 2007-08-02 US disclosed
US-20070179263-A1 Functional material comprising fluorine-containing compound DAIKIN INDUSTRIES LTD. (JP) 2007-08-02 US disclosed
US-7211203-B2 Polymer electrolyte, proton conductive membrane and membrane-electrode assembly HONDA MOTOR CO., LTD. (JP) 2007-05-01 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 (5 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-20070179263-A1 Functional material comprising fluorine-containing compound RER1, AFF1, FRG1 ALDH1A1 1283/4885TSHR 677/4885MAPK1 363/4885
US-11213550-B2 Cell preparation for treating cartilage tissue-related disorder COL2A1, MATR3, ADAMTS1 ALDH1A1 140/4885TSHR 4469/4885MAPK1 4211/4885
US-20090136868-A1 PHOTOACID GENERATOR COMPOUNDS AND COMPOSITIONS ASIC1, PPA1, PPOX ALDH1A1 2401/4885TSHR 3707/4885MAPK1 2467/4885
US-20190307807-A1 CELL PREPARATION COL2A1, MATR3, COL1A1 ALDH1A1 90/4885TSHR 4357/4885MAPK1 3750/4885
US-20110008732-A1 PHOTOACID GENERATOR COMPOUNDS AND COMPOSITIONS ASIC1, PPA1, PPOX ALDH1A1 2401/4885TSHR 3707/4885MAPK1 2467/4885

“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.