SCHEMBL5881114

SCHEMBL5881114

CCCOc1ccc(Br)cc1F

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.55
SMN1; SMN2 Q16637 5/20 0.48
NPC1 O15118 3/20 0.48
RAB9A P51151 3/20 0.48
KDM4E B2RXH2 2/20 0.48
LMNA P02545 2/20 0.48
NSD2 O96028 1/20 0.45
NSD3 Q9BZ95 1/20 0.45
HTT P42858 3/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
USP2 O75604 1/20 0.43
ALDH1A1 P00352 1/20 0.43
TP53 P04637 1/20 0.43
POLB P06746 1/20 0.43
GAA P10253 1/20 0.43
MAPT P10636 1/20 0.43
CASP1 P29466 1/20 0.43
CASP7 P55210 1/20 0.43
ATM Q13315 1/20 0.43

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
SCHEMBL1311491 0.91 SMN1; SMN2 (0.49) HPGDSMN1; SMN2NPC1RAB9AKDM4E
SCHEMBL6687682 0.89 SMN1; SMN2 (0.50) HPGDSMN1; SMN2NPC1RAB9ALMNA
SCHEMBL8216929 0.88 THRA (0.51) HPGDSMN1; SMN2NPC1RAB9ALMNA
SCHEMBL7790281 0.88 THRA (0.51) HPGDSMN1; SMN2NPC1RAB9ALMNA
SCHEMBL30294102 0.88 THRA (0.51) HPGDSMN1; SMN2NPC1RAB9ALMNA
SCHEMBL8751869 0.88 THRA (0.51) HPGDSMN1; SMN2NPC1RAB9ALMNA
SCHEMBL8751850 0.88 THRA (0.51) HPGDSMN1; SMN2NPC1RAB9ALMNA
SCHEMBL8751890 0.88 THRA (0.51) HPGDSMN1; SMN2NPC1RAB9ALMNA
SCHEMBL8216926 0.88 THRA (0.51) HPGDSMN1; SMN2NPC1RAB9ALMNA
SCHEMBL8773981 0.88 THRA (0.51) HPGDSMN1; SMN2NPC1RAB9ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112980458-B Bridged naphthene-containing liquid crystal compound and preparation method and application thereof 北京八亿时空液晶科技股份有限公司 2022-07-22 CN disclosed
CN-110499161-B Liquid crystal compound, liquid crystal composition and liquid crystal display device 石家庄诚志永华显示材料有限公司 2022-07-08 CN disclosed
CN-114105919-A Liquid crystal compound and preparation method and application thereof 北京八亿时空液晶科技股份有限公司 2022-03-01 CN disclosed
CN-114105966-A Liquid crystal compound and preparation method and application thereof 北京八亿时空液晶科技股份有限公司 2022-03-01 CN disclosed
CN-112980458-A Bridge-ring alkane-containing liquid crystal compound and preparation method and application thereof 北京八亿时空液晶科技股份有限公司 2021-06-18 CN disclosed
CN-112980460-A Liquid crystal compound and preparation method and application thereof 北京八亿时空液晶科技股份有限公司 2021-06-18 CN disclosed
WO-2021115155-A1 LIQUID CRYSTAL COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF 北京八亿时空液晶科技股份有限公司 2021-06-17 WO disclosed
CN-109207160-B Liquid crystal compound with negative dielectric anisotropy as well as preparation method and application thereof 北京八亿时空液晶科技股份有限公司 2021-05-07 CN disclosed
US-9567526-B2 Polymerizable compounds and the use thereof in liquid-crystal displays MERCK PATENT GMBH (DE) 2017-02-14 US disclosed
US-20140375943-A1 POLYMERIZABLE COMPOUNDS AND THE USE THEREOF IN LIQUID-CRYSTAL DISPLAYS MERCK PATENT GMBH (DE) 2014-12-25 US disclosed
US-6737125-B2 SUCH AS 8,9-DIFLUORO-7-(4-PENTYLPHENYL)-2-PROPYL-2,3-DIHYDRO-1H -CYCLOPENTA(A)NAPHTHALENE; FOR USE IN AUTOMOBILE INTERIORS CLARIANT FINANCE (BVI) LIMITED (VG) 2004-05-18 US disclosed
US-20040023958-A1 Inhibitors of hepatitis C virus RNA-dependent RNA polymerase, and compositions and treatments using the same AGOURON PHARMACEUTICALS, INC. 2004-02-05 US disclosed
WO-2003095441-A1 INHIBITORS OF HEPATITIS C VIRUS RNA-DEPENDENT RNA POLYMERASE, AND COMPOSITIONS AND TREATMENTS USING THE SAME PFIZER INC. (US) 2003-11-20 WO disclosed
US-20030108684-A1 Such as 8,9-difluoro-7-(4-pentylphenyl)-2-propyl-2,3-dihydro-1H -cyclopenta(a)naphthalene; for use in automobile interiors CLARIANT INTERNATIONAL LTD. 2003-06-12 US disclosed
US-6197217-B1 EXHIBIT A NEGATIVE DIELECTRIC ANISOTROPY VALUE, HAVE AN EXTREMELY HIGH VOLTAGE HOLDING RATIO AND A LOW THRESHOLD VOLTAGE, SMALL DEPENDENCY ON TEMPERATURE, HARDLY EXHIBIT SMECTIC PHASE; EXCELLENT IN MISCIBILITY WITH OTHER LC'S CHISSO CORPORATION (JP) 2001-03-06 US disclosed
EP-0959061-A1 3,3'-DIFLUOROBIPHENYL DERIVATIVES, LIQUID CRYSTAL COMPOSITIONS, AND LIQUID CRYSTAL DISPLAY ELEMENTS CHISSO CORPORATION (JP) 1999-11-24 EP disclosed
US-5977105-A Compounds ASTRA PHARMAEUTICALS LTD. (GB) 1999-11-02 US disclosed
CN-1208403-A Compounds BRITISH ASTRA PHARMACEUTICALS (GB) 1999-02-17 CN disclosed
EP-0865431-A2 COMPOUNDS Astra Pharmaceuticals Limited (GB) 1998-09-23 EP disclosed
WO-1997020815-A1 COMPOUNDS ASTRA PHARMACEUTICALS LTD. (GB) 1997-06-12 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 (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-20030108684-A1 Such as 8,9-difluoro-7-(4-pentylphenyl)-2-propyl-2,3-dihydro-1H -cyclopenta(a)naphthalene; for use in automobile interiors SCO2, CYP2F1, OGFOD1 HPGD 1706/4885SMN1; SMN2 1335/4885NPC1 37/4885
US-20040023958-A1 Inhibitors of hepatitis C virus RNA-dependent RNA polymerase, and compositions and treatments using the same POLRMT, RNGTT, RNASE1 HPGD 1963/4885SMN1; SMN2 3990/4885NPC1 694/4885

“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.