SCHEMBL517449

SCHEMBL517449

CCCCC(C)(C)NC(C)(C)CCCC

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.35
LMNA P02545 1/20 0.35
ALDH1A1 P00352 2/20 0.34
THRB P10828 1/20 0.33
FDPS P14324 1/20 0.32
EPHX1 P07099 1/20 0.30
ESR1 P03372 1/20 0.30
ESR2 Q92731 1/20 0.30

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
SCHEMBL518098 0.91 TSHR (0.39) TSHRALDH1A1THRBFDPS
SCHEMBL518405 0.88 TSHR (0.44) TSHRTHRBFDPSEPHX1
SCHEMBL517658 0.88 TSHR (0.44) TSHRTHRBFDPSEPHX1
SCHEMBL517884 0.88 TSHR (0.44) TSHRTHRBFDPSEPHX1
SCHEMBL25951863 0.88 TSHR (0.33) TSHRLMNAALDH1A1THRBFDPS
SCHEMBL1891306 0.88 TSHR (0.44) TSHRTHRBFDPSEPHX1
SCHEMBL2397669 0.88 TSHR (0.44) TSHRTHRBFDPSEPHX1
Bromide SCHEMBL31470931 0.86 TSHR (0.42) TSHRTHRBFDPSEPHX1
SCHEMBL479334 0.84 EPHX1 (0.38) TSHRALDH1A1THRBFDPSEPHX1
SCHEMBL3431417 0.80 TSHR (0.35) TSHRALDH1A1THRBFDPSEPHX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9226925-B1 Abuse deterrent and anti-dose dumping pharmaceutical salts useful for the treatment of attention deficit/hyperactivity disorder PISGAH LABORATORIES, INC. (US) 2016-01-05 US claimed
US-8940729-B1 Abuse deterrent and anti-dose dumping pharmaceutical salts useful for the treatment of attention deficit/hyperactivity disorder PISGAH LABORATORIES, INC. (US) 2015-01-27 US claimed
US-8912217-B1 Abuse deterrent and anti-dose dumping pharmaceutical salts useful for the treatment of attention deficit/hyperactivity disorder PISGAH LABORATORIES, INC. (US) 2014-12-16 US claimed
CN-119677819-A Azo compound or salt thereof, and polarizing film, polarizing plate and liquid crystal display device each containing the same 日本化药株式会社 2025-03-21 CN disclosed
EP-3395583-B1 HEAT-SENSITIVE RECORDING MATERIAL NIPPON KAYAKU KK (JP) 2024-03-27 EP disclosed
CN-114026199-B Polarized light emitting film, polarized light emitting panel and display device containing water-soluble coumarin compound or salt thereof 日本化药株式会社 2023-12-26 CN disclosed
US-11802208-B2 Stilbene-based compound or salt thereof, and polarizing film, polarizing plate, and display device NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2023-10-31 US disclosed
US-20230019461-A1 POLARIZED LIGHT-EMITTING FILM CONTAINING WATER-SOLUBLE COUMARIN COMPOUND OR SALT THEREOF, POLARIZED LIGHT-EMITTING PLATE, AND DISPLAY DEVICE NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2023-01-19 US disclosed
CN-110945083-B Styrene compound or salt thereof, polarizing film, polarizing plate and display device 日本化药株式会社 2022-07-01 CN disclosed
EP-3998502-A1 POLARIZED LIGHT-EMITTING FILM CONTAINING WATER-SOLUBLE COUMARIN COMPOUND OR SALT THEREOF, POLARIZED LIGHT-EMITTING PLATE, AND DISPLAY DEVICE Nippon Kayaku Kabushiki Kaisha (JP) 2022-05-18 EP disclosed
CN-114026199-A Polarizing luminescent film, polarizing luminescent sheet, and display device containing water-soluble coumarin compound or salt thereof 日本化药株式会社 2022-02-08 CN disclosed
US-8653065-B1 Abuse deterrent and anti-dose dumping pharmaceutical salts useful for the treatment of attention deficit/hyperactivity disorder PISGAH LABORATORIES, INC. (US) 2014-02-18 US disclosed
US-20130338229-A1 Abuse-Deterrent Methadone for the Safe Treatment of Drug Abuse and Pain Relief Pisgah National Laboratories, Inc. (US) 2013-12-19 US disclosed
US-8586575-B1 Abuse deterrent and anti-dose dumping pharmaceutical salts useful for the treatment of attention deficit/hyperactivity disorder PISGAH LABORATORIES, INC. (US) 2013-11-19 US disclosed
US-20120028960-A1 ABUSE DETERRENT AND ANTI-DOSE DUMPING PHARMACEUTICAL SALTS USEFUL FOR THE TREATMENT OF ATTENTION DEFICIT/HYPERACTIVITY DISORDER PISGAH LABORATORIES, INC. 2012-02-02 US disclosed
US-20110233048-A1 PHOTOBASE GENERATOR WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 2011-09-29 US disclosed
EP-2368875-A1 PHOTOBASE GENERATOR Wako Pure Chemical Industries, Ltd. (JP) 2011-09-28 EP disclosed
EP-0922709-B1 PROCESS FOR PRODUCING (METH)ACRYLATE DERIVATIVES NOF CORP (JP) 2003-07-09 EP disclosed
US-5981786-A REACTING UNSATURATED ESTER WITH A CHLORO-DIOXAPHOSPHORUS DERIVATIVE IN THE PRESENCE OF A SECONDARY AMINE NOF CORPORATION (JP) 1999-11-09 US disclosed
EP-0922709-A1 PROCESS FOR PRODUCING (METH)ACRYLATE DERIVATIVES NOF CORPORATION (JP) 1999-06-16 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 (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-20130338229-A1 Abuse-Deterrent Methadone for the Safe Treatment of Drug Abuse and Pain Relief OPRM1, OGFR, OPRK1 TSHR 2195/4885LMNA 3509/4885ALDH1A1 469/4885
US-20110233048-A1 PHOTOBASE GENERATOR CYBA, CRY1, GNB1 TSHR 3162/4885LMNA 1632/4885ALDH1A1 503/4885
US-20120028960-A1 ABUSE DETERRENT AND ANTI-DOSE DUMPING PHARMACEUTICAL SALTS USEFUL FOR THE TREATMENT OF ATTENTION DEFICIT/HYPERACTIVITY DISORDER COMT, SLC6A3, SLC6A2 TSHR 2160/4885LMNA 4501/4885ALDH1A1 235/4885

“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.