SCHEMBL4867079

SCHEMBL4867079

CCCCCCCCOc1ccc(-c2ccc(Br)cc2)cc1

nearest known ligand 0.61

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RARB P10826 4/20 0.61
NR5A1 Q13285 1/20 0.59
CYP3A4 P08684 3/20 0.58
CYP2D6 P10635 3/20 0.58
LTA4H P09960 3/20 0.53
CYP19A1 P11511 2/20 0.53
CYP2C9 P11712 2/20 0.53
CYP2C19 P33261 2/20 0.53
TP53 P04637 1/20 0.53
TSHR P16473 1/20 0.53
CYP1A2 P05177 1/20 0.53
MAPT P10636 1/20 0.52
PLA2G4B P0C869 1/20 0.51
KDM4E B2RXH2 2/20 0.50
ALDH1A1 P00352 2/20 0.50
HPGD P15428 2/20 0.50
HTT P42858 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50

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
SCHEMBL7697448 1.00 RARB (0.61) RARBNR5A1CYP3A4CYP2D6LTA4H
SCHEMBL12972983 1.00 RARB (0.61) RARBNR5A1CYP3A4CYP2D6LTA4H
SCHEMBL2356972 1.00 RARB (0.61) RARBNR5A1CYP3A4CYP2D6LTA4H
SCHEMBL2356412 1.00 RARB (0.61) RARBNR5A1CYP3A4CYP2D6LTA4H
SCHEMBL1792760 1.00 RARB (0.61) RARBNR5A1CYP3A4CYP2D6LTA4H
SCHEMBL2357155 0.98 CYP2D6 (0.59) RARBNR5A1CYP3A4CYP2D6LTA4H
SCHEMBL7330936 0.94 CYP2D6 (0.63) RARBCYP3A4CYP2D6LTA4HCYP19A1
SCHEMBL1102341 0.94 NR5A1 (0.66) RARBNR5A1LTA4HTP53TSHR
SCHEMBL8215140 0.94 NR5A1 (0.66) RARBNR5A1LTA4HTP53TSHR
SCHEMBL6740617 0.94 NR5A1 (0.66) RARBNR5A1LTA4HTP53TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10923662-B2 Fluoroalkylfluorene derivatives LOMOX LIMITED (GB) 2021-02-16 US disclosed
EP-3131898-B1 FLUOROALKYLFLUORENE DERIVATIVES LOMOX LTD (GB) 2020-03-18 EP disclosed
US-10084137-B2 Fluoroalkylfluorene derivatives LOMOX LIMITED (GB) 2018-09-25 US disclosed
US-20180261771-A1 FLUOROALKYLFLUORENE DERIVATIVES LOMOX LIMITED (GB) 2018-09-13 US disclosed
EP-3131898-A1 FLUOROALKYLFLUORENE DERIVATIVES Lomox Limited (GB) 2017-02-22 EP disclosed
US-20170033290-A1 FLUOROALKYLFLUORENE DERIVATIVES LOMOX LIMITED (GB) 2017-02-02 US disclosed
WO-2015159098-A1 FLUOROALKYLFLUORENE DERIVATIVES LOMOX LIMITED (GB) 2015-10-22 WO disclosed
US-7851074-B2 Organic electroluminescent display device and chemical compounds for liquid crystals TOHOKU PIONEER CORPORATION (JP) 2010-12-14 US disclosed
US-20090058277-A1 Organic Electroluminescent Display Device and Chemical Compounds for Liquid Crystals TOHOKU PIONEER CORPORATION (JP) 2009-03-05 US disclosed
US-7351452-B2 Liquid crystalline compounds containing a biphenyl core QINETIQ LIMITED (GB) 2008-04-01 US disclosed
EP-0360042-A1 p-Terphenyl derivatives and liquid crystalline compositions KANTO KAGAKU KABUSHIKI KAISHA (JP) 1990-03-28 EP disclosed
EP-0201578-B1 ALPHA-HYDROXY CARBOXYLIC ACID DERIVATIVES SUITABLE FOR USE IN LIQUID CRYSTAL MATERIALS AND DEVICES The Secretary of State for Defence in Her Britannic Majesty's Government of the United Kingdom of Great Britain and (GB) 1989-11-02 EP disclosed
US-4873019-A LIQUID CRYSTALS MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1989-10-10 US disclosed
US-4852977-A 19 -hydroxy carboxylic acid derivatives suitable for use in liquid crystal materials 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) 1989-08-01 US disclosed
EP-0261160-A1 Alicyclic compounds. MERCK PATENT GMBH (DE) 1988-03-30 EP disclosed
EP-0257048-A1 OPTICALLY ACTIVE COMPOUNDS. MERCK PATENT GMBH (DE) 1988-03-02 EP disclosed
WO-1987005599-A1 TERTIARY ALCOHOLS MERCK Patent Gesellschaft mit beschränkter Haftung (DE) 1987-09-24 WO disclosed
WO-1987005018-A2 OPTICALLY ACTIVE COMPOUNDS MERCK Patent Gesellschaft mit beschränkter Haftung (DE) 1987-08-27 WO disclosed
EP-0201578-A1 ALPHA-HYDROXY CARBOXYLIC ACID DERIVATIVES SUITABLE FOR USE IN LIQUID CRYSTAL MATERIALS AND DEVICES. SECR DEFENCE BRIT (GB) 1986-11-20 EP disclosed
WO-1986002938-A1 ALPHA-HYDROXY CARBOXYLIC ACID DERIVATIVES SUITABLE FOR USE IN LIQUID CRYSTAL MATERIALS AND DEVICES THE SECRETARY OF STATE FOR DEFENCE IN HER BRITANNI (GB) 1986-05-22 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 (4 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-10084137-B2 Fluoroalkylfluorene derivatives FLNB, AFF2, EFHD2 RARB 2518/4885NR5A1 4015/4885CYP3A4 953/4885
US-20170033290-A1 FLUOROALKYLFLUORENE DERIVATIVES FLNB, AFF2, EFHD2 RARB 2518/4885NR5A1 4015/4885CYP3A4 953/4885
US-10923662-B2 Fluoroalkylfluorene derivatives FLNB, AFF2, EFHD2 RARB 2518/4885NR5A1 4015/4885CYP3A4 953/4885
US-20180261771-A1 FLUOROALKYLFLUORENE DERIVATIVES FLNB, AFF2, EFHD2 RARB 2518/4885NR5A1 4015/4885CYP3A4 953/4885

“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.