SCHEMBL642402

SCHEMBL642402

BrCc1cc(Br)cc(CBr)c1

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 3/20 0.40
TSHR P16473 2/20 0.38
TRPA1 O75762 1/20 0.38
ALDH1A1 P00352 1/20 0.38
TAAR1 Q96RJ0 1/20 0.32
CYP3A4 P08684 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
AGXT P21549 2/20 0.31

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
SCHEMBL400236 0.93 IDO1 (0.46) IDO1TSHRTRPA1ALDH1A1TAAR1
SCHEMBL13973047 0.87 ACHE (0.40) IDO1TSHRTRPA1ALDH1A1CYP3A4
SCHEMBL8447346 0.87 IDO1 (0.33) IDO1TSHRTRPA1ALDH1A1
SCHEMBL331501 0.86 TRPA1 (0.47) TSHRTRPA1ALDH1A1
SCHEMBL24661052 0.81 IDO1 (0.38) IDO1TSHRTRPA1ALDH1A1TAAR1
SCHEMBL10448080 0.81 IDO1 (0.33) IDO1TSHRTRPA1ALDH1A1
SCHEMBL29999249 0.81 TSHR (0.40) IDO1TSHRTRPA1ALDH1A1CYP3A4
SCHEMBL30349373 0.81 TACR1 (0.41) IDO1TSHRTRPA1ALDH1A1
SCHEMBL29472374 0.81 IDO1 (0.34) IDO1TSHRTRPA1ALDH1A1
SCHEMBL305652 0.81 TACR1 (0.41) IDO1TSHRTRPA1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103570483-A Preparation method for 3, 5-dithienylethene benzaldehyde UNIV JINAN 2014-02-12 CN claimed
EP-4636054-A2 NARROW EMISSION DYES, COMPOSITIONS COMPRISING SAME, AND METHODS FOR MAKING AND USING SAME NIRvana Sciences Inc. (US) 2025-10-22 EP disclosed
EP-3959292-B1 NARROW EMISSION DYES, COMPOSITIONS COMPRISING SAME, AND METHODS FOR MAKING AND USING SAME NIRVANA SCIENCES INC (US) 2025-07-02 EP disclosed
WO-2025082283-A1 LIGAND COMPOUND OF CYCLOPEPTIDE STRUCTURE, NUCLIDE MARKER THEREOF, PHARMACEUTICAL COMPOSITION, AND USE 四川科伦博泰生物医药股份有限公司 2025-04-24 WO disclosed
CN-119752217-A Narrow emission dyes, compositions comprising the same, and methods of making and using the same 尼尔瓦纳科学股份有限公司 2025-04-04 CN disclosed
CN-114222803-B Narrow emission dyes, compositions comprising the same, and methods of making and using the same 尼尔瓦纳科学股份有限公司 2025-01-07 CN disclosed
EP-3959293-B1 NARROW EMISSION DYES, COMPOSITIONS COMPRISING SAME, AND METHODS FOR MAKING AND USING SAME NIRVANA SCIENCES INC (US) 2024-11-13 EP disclosed
US-20220249708-A1 NARROW EMISSION DYES, COMPOSITIONS COMPRISING SAME, AND METHODS FOR MAKING AND USING SAME NIRVANA SCIENCES INC. (US) 2022-08-11 US disclosed
US-20220249707-A1 NARROW EMISSION DYES, COMPOSITIONS COMPRISING SAME, AND METHODS FOR MAKING AND USING SAME NIRVANA SCIENCES INC. (US) 2022-08-11 US disclosed
CN-114222802-A Narrow emission dyes, compositions comprising the same, and methods of making and using the same 尼尔瓦纳科学股份有限公司 2022-03-22 CN disclosed
EP-1189609-A1 CXCR-4 RECEPTOR ANTAGONISTS - THROMBOPOIETIN MIMETICS SMITHKLINE BEECHAM CORPORATION (US) 2002-03-27 EP disclosed
WO-2001000578-A1 1-(AROMATIC- OR HETEROAROMATIC-SUBSTITUTED)-3-(HETEROAROMATIC SUBSTITUTED)-1,3-PROPANEDIONES AND USES THEREOF MERCK & CO., INC. (US) 2001-01-04 WO disclosed
WO-2000066112-A1 CXCR-4 RECEPTOR ANTAGONISTS - THROMBOPOIETIN MIMETICS SMITHKLINE BEECHAM CORPORATION (US) 2000-11-09 WO disclosed
EP-0707624-B1 PERFLUORO-1H-1H-NEOPENTYL CONTAINING CONTRAST AGENTS AND METHOD TO USE SAME MOLECULAR BIOSYSTEMS INC (US) 2000-05-10 EP disclosed
US-5877214-A Polyaryl-poly(ethylene glycol) supports for solution-phase combinatorial synthesis MERCK & CO., INC. (US) 1999-03-02 US disclosed
WO-1996015134-A1 L-α-AMINO-3-BIPHENYL-PROPANOIC ACID DERIVATIVE NOVARTIS AG (CH) 1996-05-23 WO disclosed
EP-0707624-A1 PERFLUORO-1H-1H-NEOPENTYL CONTAINING CONTRAST AGENTS AND METHOD TO USE SAME MOLECULAR BIOSYSTEMS, INC. (US) 1996-04-24 EP disclosed
EP-0707624-A4 PERFLUORO-1H-1H-NEOPENTYL CONTAINING CONTRAST AGENTS AND METHOD TO USE SAME MOLECULAR BIOSYSTEMS INC (US) 1996-02-29 EP disclosed
US-5401493-A Perfluoro-1H,-1H-neopentyl containing contrast agents and method to use same MOLECULAR BIOSYSTEMS, INC. (US) 1995-03-28 US disclosed
WO-1994022368-A1 PERFLUORO-1H-1H-NEOPENTYL CONTAINING CONTRAST AGENTS AND METHOD TO USE SAME MOLECULAR BIOSYSTEMS, INC. (US) 1994-10-13 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-20220249707-A1 NARROW EMISSION DYES, COMPOSITIONS COMPRISING SAME, AND METHODS FOR MAKING AND USING SAME AQP4, CLSPN, CHLSN IDO1 2350/4885TSHR 1806/4885TRPA1 2454/4885
US-20220249708-A1 NARROW EMISSION DYES, COMPOSITIONS COMPRISING SAME, AND METHODS FOR MAKING AND USING SAME MB, LNPEP, BCR IDO1 1621/4885TSHR 3247/4885TRPA1 2467/4885

“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.