SCHEMBL429654

SCHEMBL429654

CCCCOc1ccc(B(O)O)c(F)c1F

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 3/20 0.40
CYP2C19 P33261 3/20 0.40
CYP2C9 P11712 2/20 0.40
L3MBTL1 Q9Y468 3/20 0.38
TDP1 Q9NUW8 2/20 0.37
CYP2D6 P10635 1/20 0.37
ESR1 P03372 1/20 0.36
LTA4H P09960 1/20 0.36
NR5A1 Q13285 1/20 0.36
CA9 Q16790 1/20 0.35
LIPG Q9Y5X9 1/20 0.35
GLA P06280 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
CYP19A1 P11511 1/20 0.35
GAA P10253 1/20 0.35
S1PR3 Q99500 1/20 0.35
CNR1 P21554 1/20 0.35
CNR2 P34972 1/20 0.35

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
SCHEMBL29562631 1.00 CYP1A2 (0.40) CYP1A2CYP2C19CYP2C9L3MBTL1TDP1
SCHEMBL29545875 0.95 L3MBTL1 (0.40) L3MBTL1ESR1NR5A1LIPGS1PR3
SCHEMBL8746461 0.95 L3MBTL1 (0.40) L3MBTL1ESR1NR5A1LIPGS1PR3
SCHEMBL8746439 0.93 S1PR3 (0.42) L3MBTL1ESR1NR5A1LIPGS1PR3
SCHEMBL8218479 0.93 S1PR3 (0.42) L3MBTL1ESR1NR5A1LIPGS1PR3
SCHEMBL29416793 0.93 S1PR3 (0.42) L3MBTL1ESR1NR5A1LIPGS1PR3
SCHEMBL4827415 0.93 S1PR3 (0.42) L3MBTL1ESR1NR5A1LIPGS1PR3
SCHEMBL2510510 0.93 S1PR3 (0.42) L3MBTL1ESR1NR5A1LIPGS1PR3
SCHEMBL8746471 0.93 S1PR3 (0.42) L3MBTL1ESR1NR5A1LIPGS1PR3
SCHEMBL29950981 0.93 S1PR3 (0.42) L3MBTL1ESR1NR5A1LIPGS1PR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110922306-B Synthesis process of 2, 3-difluoro-4-alkoxyl phenol 蚌埠中实化学技术有限公司 2023-09-29 CN claimed
US-12460133-B2 Liquid crystal compound, liquid crystal composition thereof, and liquid crystal display device JIANGSU HECHENG DISPLAY TECHNOLOGY CO., LTD. (CN) 2025-11-04 US disclosed
US-20250171690-A1 LIQUID CRYSTAL COMPOUND, LIQUID CRYSTAL COMPOSITION THEREOF, AND LIQUID CRYSTAL DISPLAY DEVICE JIANGSU HECHENG DISPLAY TECHNOLOGY CO., LTD. (CN) 2025-05-29 US disclosed
EP-3670503-B1 COMPOUND, LIQUID CRYSTAL MEDIUM CONTAINING SAME, AND USE THEREOF SHIJIAZHUANG CHENGZHI YONGHUA DISPLAY MATERIALS CO LTD (CN) 2023-10-18 EP disclosed
CN-115490582-B Preparation method of fluorine-containing biphenyl alkene negative monomer liquid crystal compound 烟台德润液晶材料有限公司 2023-10-10 CN disclosed
CN-110922306-B Synthesis process of 2, 3-difluoro-4-alkoxyl phenol 蚌埠中实化学技术有限公司 2023-09-29 CN disclosed
CN-114262323-B Negative dielectric anisotropic liquid crystal compound, composition and display element 西安近代化学研究所 2023-09-08 CN disclosed
WO-2023071657-A1 LIQUID CRYSTAL COMPOUND, LIQUID CRYSTAL COMPOSITION THEREOF, AND LIQUID CRYSTAL DISPLAY DEVICE 江苏和成显示科技有限公司 2023-05-04 WO disclosed
CN-110117277-B Negative liquid crystal monomer and preparation method thereof 河北迈尔斯通电子材料有限公司 2022-12-30 CN disclosed
CN-115490582-A Preparation method of fluorine-containing biphenyl alkene negative monomer liquid crystal compound 烟台德润液晶材料有限公司 2022-12-20 CN disclosed
EP-2266941-B1 TRICYCLIC LIQUID CRYSTALLINE COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORP (JP) 2014-03-05 EP disclosed
US-8216489-B2 Three-ring liquid crystal compound having lateral fluorine, liquid crystal composition, and liquid crystal display device JNC CORPORATION (JP) 2012-07-10 US disclosed
US-20120018672-A1 LIQUID CRYSTAL COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE CHISSO PETROCHEMICAL CORPORATION (JP) 2012-01-26 US disclosed
US-20110037024-A1 THREE-RING LIQUID CRYSTAL COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE CHISSO CORPORATION (JP) 2011-02-17 US disclosed
EP-2266941-A1 TRICYCLIC LIQUID CRYSTALLINE COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE Chisso Corporation (JP) 2010-12-29 EP disclosed
US-7255900-B2 Fluorinated heterocycles and their use in liquid-crystal mixtures MERCK PATENT GMBH (DE) 2007-08-14 US disclosed
US-20050258399-A1 Fluorinated heterocycles and their use in liquid-crystal mixtures MERCK PATENT GMBH (DE) 2005-11-24 US disclosed
EP-1144546-A3 FLUORINATED TERPHENYLS QinetiQ Limited (GB) 2002-08-28 EP disclosed
EP-1144546-A2 FLUORINATED TERPHENYLS QinetiQ Limited (GB) 2001-10-17 EP disclosed
WO-2000004111-A2 FLUORINATED TERPHENYLS THE SECRETARY OF STATE FOR DEFENCE (GB) 2000-01-27 WO 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-20120018672-A1 LIQUID CRYSTAL COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE ROCK2, ROCK1, LEF1 CYP1A2 1044/4885CYP2C19 3314/4885CYP2C9 2917/4885
US-20110037024-A1 THREE-RING LIQUID CRYSTAL COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE LEF1, LAS1L, L3MBTL3 CYP1A2 1655/4885CYP2C19 2570/4885CYP2C9 3095/4885
US-20050258399-A1 Fluorinated heterocycles and their use in liquid-crystal mixtures CHRM1, AFF1, H1-0 CYP1A2 328/4885CYP2C19 1342/4885CYP2C9 1649/4885

“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.