SCHEMBL222565

SCHEMBL222565

CCCCCc1ccc(-c2ccc(Br)cc2F)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 9/20 0.61
RARA P10276 2/20 0.48
RARG P13631 1/20 0.48
HTR2A P28223 1/20 0.45
RAB9A P51151 3/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
NPC1 O15118 2/20 0.44
NFKB1 P19838 2/20 0.44
NFKB2 Q00653 2/20 0.44
RELA Q04206 2/20 0.44
GAA P10253 2/20 0.44
MAPK1 P28482 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
HSD17B10 Q99714 3/20 0.42
TSHR P16473 1/20 0.42
ALDH1A1 P00352 3/20 0.41
ESR1 P03372 2/20 0.41
ADRA2A P08913 2/20 0.41
ADORA3 P0DMS8 2/20 0.41
TACR2 P21452 2/20 0.41

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
SCHEMBL6685346 0.98 RARB (0.64) RARBRARARARGHTR2ARAB9A
SCHEMBL6687468 0.98 RARB (0.64) RARBRARARARGHTR2ARAB9A
SCHEMBL6686529 0.98 RARB (0.64) RARBRARARARGHTR2ARAB9A
SCHEMBL4186955 0.95 RARB (0.56) RARBRARARARGHTR2ARAB9A
SCHEMBL9176105 0.91 RARB (0.58) RARBRARARARGHTR2ARAB9A
SCHEMBL6684291 0.89 RARB (0.48) RARBHTR2ARAB9ASMN1; SMN2NPC1
SCHEMBL9398982 0.87 RARB (0.68) RARBRARARARGHTR2ARAB9A
SCHEMBL10979477 0.86 RARB (0.70) RARBRARARARGHTR2ARAB9A
SCHEMBL10975095 0.86 RARB (0.70) RARBRARARARGHTR2ARAB9A
SCHEMBL14175167 0.86 RARB (0.66) RARBRARARARGHTR2AHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107011920-B Liquid-crystalline medium comprising thiophene derivatives 默克专利股份有限公司 2021-06-22 CN disclosed
US-9868906-B2 Liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2018-01-16 US disclosed
US-9868906-B2 Liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2018-01-16 US disclosed
US-9714383-B2 Liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2017-07-25 US disclosed
US-9714383-B2 Liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2017-07-25 US disclosed
US-9714383-B2 Liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2017-07-25 US disclosed
US-20160168463-A1 LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORPORATION (JP) 2016-06-16 US disclosed
US-20160168463-A1 LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORPORATION (JP) 2016-06-16 US disclosed
US-20160168463-A1 LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORPORATION (JP) 2016-06-16 US disclosed
US-20160137922-A1 LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORPORATION (JP) 2016-05-19 US disclosed
US-5437815-A Blending with ordinary liquid crystal compounds broadens practical temperature range of composition and produces an enlarged double refraction anisotropy SEIKO EPSON CORPORATION (JP) 1995-08-01 US disclosed
EP-0414230-B1 Liquid crystal composition and liquid crystal device containing the same SHARP KK (JP) 1995-01-04 EP disclosed
US-5271867-A Liquid crystal composition and liquid crystal device containing the same SHARP KABUSHIKI KAISHA (JP) 1993-12-21 US disclosed
EP-0535635-A1 Tolane derivative, liquid crystal composition containing the derivative, and liquid crystal display device using the composition SEIKO EPSON CORPORATION (JP) 1993-04-07 EP disclosed
EP-0414230-A2 Liquid crystal composition and liquid crystal device containing the same SHARP KABUSHIKI KAISHA (JP) 1991-02-27 EP disclosed
EP-0407569-A1 DIPHENYLETHANES MERCK PATENT GmbH (DE) 1991-01-16 EP disclosed
EP-0132377-B1 COMPOUNDS CONTAINING A FLUOROBIPHENYLYL GROUP AND THEIR USE IN LIQUID CRYSTAL MATERIALS AND DEVICE The Secretary of State for Defence in Her Britannic Majesty's Government of the United Kingdom of Great Britain and (GB) 1988-06-29 EP disclosed
US-4696549-A Compounds containing a fluorobiphenylyl group and their use in liquid crystal material and devices THE SECRETARY OF STATE FOR DEFENCE IN HER BRITANNIC MAJESTY'S GOVERNMENT OF THE UNITED KINGDOM OF GREAT BRITAIN AND NORTHERN IRELAND (GB) 1987-09-29 US disclosed
US-4594465-A Compounds containing a fluorobiphenylyl group THE SECRETARY OF STATE FOR DEFENCE IN HER BRITANNIC MAJESTY'S GOVERNMENT OF THE UNITED KINGDOM OF GREAT BRITAIN AND NORTHERN IRELAND (GB) 1986-06-10 US disclosed
EP-0132377-A2 Compounds containing a fluorobiphenylyl group and their use in liquid crystal materials and device The Secretary of State for Defence in Her Britannic Majesty's Government of the United Kingdom of Great Britain and (GB) 1985-01-30 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 (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-20160137922-A1 LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE VCL, LASP1, L1CAM RARB 2084/4885RARA 979/4885RARG 1874/4885
US-20160168463-A1 LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE NLK, NCAPD2, LASP1 RARB 2356/4885RARA 1600/4885RARG 1993/4885

“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.