SCHEMBL547985

SCHEMBL547985

ClCc1ccccc1OCc1ccccc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 3/20 0.67
DRD2 P14416 3/20 0.67
ABCB1 P08183 4/20 0.56
GAA P10253 2/20 0.56
MAPT P10636 2/20 0.55
TDP1 Q9NUW8 2/20 0.55
L3MBTL1 Q9Y468 2/20 0.55
MAPK1 P28482 1/20 0.55
LMNA P02545 2/20 0.53
KDM4E B2RXH2 1/20 0.53
MEN1 O00255 1/20 0.53
ALDH1A1 P00352 1/20 0.53
TP53 P04637 1/20 0.53
THRB P10828 1/20 0.53
HPGD P15428 1/20 0.53
BLM P54132 1/20 0.53
KMT2A Q03164 1/20 0.53
LIPE Q05469 1/20 0.50
MGLL Q99685 1/20 0.49
PTGER1 P34995 1/20 0.49

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
Acetonitrile SCHEMBL27809938 0.90 HTR1A (0.56) HTR1ADRD2ABCB1GAAMAPT
SCHEMBL8707848 0.90 HTR1A (0.56) HTR1ADRD2ABCB1GAAMAPT
SCHEMBL32670477 0.87 ALDH1A1 (0.62) HTR1ADRD2ABCB1MAPTMAPK1
SCHEMBL3243180 0.85 HTR1A (0.54) HTR1ADRD2ABCB1GAAMAPT
SCHEMBL7450789 0.84 MAPT (0.71) HTR1ADRD2ABCB1GAAMAPT
SCHEMBL3996790 0.84 DRD2 (0.57) HTR1ADRD2ABCB1GAAMAPT
SCHEMBL29087574 0.84 RXRA (0.68) MAPTKDM4EALDH1A1HPGDKMT2A
SCHEMBL9277698 0.83 HTR1A (0.71) HTR1ADRD2ABCB1GAAMAPT
SCHEMBL2394736 0.83 L3MBTL1 (0.48) HTR1ADRD2MAPTTDP1L3MBTL1
SCHEMBL7450663 0.83 HTR1A (0.51) HTR1ADRD2ABCB1GAAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101279899-B Preparation of phenol 2-[2-(3-methoxyphenyl) ethyl] UNIV CHINA PHARMA 2010-06-02 CN claimed
CN-101279899-A Preparation of phenol 2-[2-(3-methoxyphenyl) ethyl] UNIV CHINA PHARMA (CN) 2008-10-08 CN claimed
EP-0873293-B1 IMPROVED PROCESS FOR THE PREPARATION OF ALKYL OR ARYL ALDEHYDE INTERMEDIATES ABBOTT LAB (US) 2001-07-25 EP claimed
EP-0873293-A1 IMPROVED PROCESS FOR THE PREPARATION OF ALKYL OR ARYL ALDEHYDE INTERMEDIATES Abbott Laboratories (US) 1998-10-28 EP claimed
WO-1997023439-A1 IMPROVED PROCESS FOR THE PREPARATION OF ALKYL OR ARYL ALDEHYDE INTERMEDIATES ABBOTT LABORATORIES (US) 1997-07-03 WO claimed
EP-3782996-B1 NRF2 REGULATORS GLAXOSMITHKLINE IP DEV LTD (GB) 2024-04-10 EP disclosed
US-20230047296-A1 Nrf2 REGULATORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2023-02-16 US disclosed
EP-3796906-A1 INDANES AS NRF2 ACTIVATORS GlaxoSmithKline Intellectual Property Management Limited (GB) 2021-03-31 EP disclosed
CN-108112251-B NRF2 modulators 葛兰素史克知识产权发展有限公司 2021-03-05 CN disclosed
EP-3782996-A1 NRF2 REGULATORS GlaxoSmithKline Intellectual Property Development Limited (GB) 2021-02-24 EP disclosed
EP-3307739-B1 NRF2 REGULATORS GLAXOSMITHKLINE IP DEV LTD (GB) 2020-10-07 EP disclosed
US-10604509-B2 Nrf2 regulators GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2020-03-31 US disclosed
EP-0207605-B1 HYPOGLYCEMIC THIAZOLIDINEDIONES PFIZER INC. (US) 1990-02-07 EP disclosed
US-4703052-A Hypoglycemic thiazolidinediones PFIZER INC. (US) 1987-10-27 US disclosed
EP-0230893-A2 Paramagnetic chelates BRACCO INDUSTRIA CHIMICA Società per Azioni (IT) 1987-08-05 EP disclosed
CN-86104075-A Preparation method of hypoglycemic agent-thiazolidinedione 1987-03-11 CN disclosed
EP-0207605-A1 Hypoglycemic thiazolidinediones PFIZER INC. (US) 1987-01-07 EP disclosed
WO-1986007056-A1 HYPOGLYCEMIC THIAZOLIDINEDIONES PFIZER INC. (US) 1986-12-04 WO disclosed
US-4012389-A ANTICOAGULANTS DONAU-PHARMAZIE GESELLSCHAFT M.B.H. (OE) 1977-03-15 US disclosed
US-3935214-A ANTICOAGULANT DONAU-PHARMAZIE GESELLSCHAFT M.B.H. (OE) 1976-01-27 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 (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-10604509-B2 Nrf2 regulators NFE2L2, KEAP1, NQO1 HTR1A 2726/4885DRD2 3638/4885ABCB1 375/4885
US-20230047296-A1 Nrf2 REGULATORS NFE2L2, KEAP1, NQO1 HTR1A 2782/4885DRD2 3932/4885ABCB1 264/4885

“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.