SCHEMBL71123

SCHEMBL71123

BrCc1ccc(-c2ccccc2)cc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.68
TSHR P16473 2/20 0.68
TRPA1 O75762 1/20 0.68
TAAR1 Q96RJ0 3/20 0.56
CES2 O00748 1/20 0.52
CES1 P23141 1/20 0.52
IDO1 P14902 2/20 0.50
AGXT P21549 2/20 0.50
MAPK1 P28482 1/20 0.50
ABCC4 O15439 1/20 0.50
LMNA P02545 1/20 0.50
GAA P10253 1/20 0.50
PTGS1 P23219 1/20 0.50
HTT P42858 1/20 0.50
PTPN1 P18031 1/20 0.46
GSK3B P49841 1/20 0.46
FFAR1 O14842 1/20 0.46
TDP1 Q9NUW8 2/20 0.43
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 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
SCHEMBL28096322 1.00 ALDH1A1 (0.68) ALDH1A1TSHRTRPA1TAAR1CES2
SCHEMBL1374017 1.00 ALDH1A1 (0.68) ALDH1A1TSHRTRPA1TAAR1CES2
Biphenyl SCHEMBL27732862 1.00 ALDH1A1 (0.68) ALDH1A1TSHRTRPA1TAAR1CES2
Hydrochloric Acid SCHEMBL28118078 0.97 ALDH1A1 (0.65) ALDH1A1TSHRTRPA1TAAR1CES2
SCHEMBL5498364 0.95 ALDH1A1 (0.62) ALDH1A1TSHRTRPA1TAAR1CES2
Biphenyl SCHEMBL7524026 0.92 TSHR (0.82) ALDH1A1TSHRTRPA1TAAR1CES2
SCHEMBL679626 0.88 TSHR (0.56) ALDH1A1TSHRTRPA1TAAR1CES2
SCHEMBL9609757 0.88 TSHR (0.56) ALDH1A1TSHRTRPA1TAAR1CES2
SCHEMBL9023806 0.87 ALDH1A1 (0.59) ALDH1A1TSHRTRPA1TAAR1CES2
Acetic Acid SCHEMBL28491683 0.87 CES2 (0.57) ALDH1A1TSHRTRPA1TAAR1CES2

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 1441 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4724442-A1 AGONISM-ANTAGONISM IN ENDOSOMAL TLRS BY MODULATING CHEMICAL FEATURES IN 8-OXOPURINE: PROCESS FOR PREPARATION AND APPLICATION THEREOF Council of Scientific and Industrial Research (IN) 2026-04-15 EP claimed
US-12509426-B1 Carbon-14 radioisotope-labeled flonicamid and synthesis method thereof Zhejiang Isotope Labelled Compounds Co., Ltd (CN) 2025-12-30 US claimed
CN-120040988-A Unconventional dye for regulating and controlling photosensitive Type I/II process switching of tumor microenvironment and synthetic method and application thereof 大连理工大学 2025-05-27 CN claimed
CN-115850002-B Method for hydrodehalogenating halogenated alkane 中国科学院兰州化学物理研究所 2025-05-23 CN claimed
CN-115959962-B Visible light-promoted halogenated alkane hydrodehalogenation method 中国科学院兰州化学物理研究所 2025-05-23 CN claimed
US-12304917-B1 Pleuromutilin derivative containing a thiazolo[5,4-c]pyridine side chain, and a preparation method and application thereof SHAANXI UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2025-05-20 US claimed
US-12275734-B1 Pleuromutilin onium salt derivative containing a 3H-imidazo[4,5-c]pyridine side chain, and a preparation method and application thereof SHAANXI UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2025-04-15 US claimed
CN-119285540-B Radioisotope carbon-14 labeled flonicamid and synthesis method thereof 浙江爱索拓标记医药科技有限公司 2025-04-04 CN claimed
CN-119409638-A Preparation method and application of imidazole-based ionic liquid corrosion inhibitor 四川轻化工大学 2025-02-11 CN claimed
CN-119285540-A Radioisotope carbon-14 labeled flonicamid and synthesis method thereof 浙江爱索拓标记医药科技有限公司 2025-01-10 CN claimed
WO-2005122699-A2 AN IMPROVED PROCESS FOR THE PREPARATION OF N-SUBSTITUTED HETERO CYCLIC DERIVATIVES MATRIX LABORATORIES LTD (IN) 2005-12-29 WO claimed
EP-1210322-B1 METHOD FOR CARRYING OUT THE SIDE CHAIN BROMINATION OF 4-METHYL BIPHENYL DERIVATIVES SUBSTITUTED AT THE 2'-POSITION BOEHRINGER INGELHEIM PHARMA (DE) 2005-02-09 EP claimed
EP-1032557-B1 METHOD FOR PREPARING BROMOMETHYL-BIPHENYL DERIVATIVES SANOFI SYNTHELABO (FR) 2003-09-10 EP claimed
US-20020095042-A1 Process for brominating the side chain of 4-methylbiphenyl derivatives substituted in the 2' position BOEHRINGER INGELHEIM PHARMA KG (DE) 2002-07-18 US claimed
US-6214999-B1 A BROMINATING AGENT IS REACTED IN A 2 PHASE MEDIUM, UNDER EFFECT PHOTO-IRRADIATION WITH BIPHENYL DERIVATIVE SANOFI-SYNTHELABO (FR) 2001-04-10 US claimed
EP-1032557-A1 METHOD FOR PREPARING BROMOMETHYL-BIPHENYL DERIVATIVES SANOFI-SYNTHELABO (FR) 2000-09-06 EP claimed
WO-1999025681-A1 METHOD FOR PREPARING BROMOMETHYL-BIPHENYL DERIVATIVES SANOFI-SYNTHELABO (FR) 1999-05-27 WO claimed
EP-0553879-B1 Process for producing 4-bromomethylbiphenyl compounds TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1996-08-14 EP claimed
US-5312958-A Process for producing 4-bromomethylbiphenyl compounds TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1994-05-17 US claimed
EP-0553879-A2 Process for producing 4-bromomethylbiphenyl compounds TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1993-08-04 EP claimed

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-12275734-B1 Pleuromutilin onium salt derivative containing a 3H-imidazo[4,5-c]pyridine side chain, and a preparation method and application thereof PLEC, PML, MRPL21 ALDH1A1 2527/4885TSHR 1783/4885TRPA1 1822/4885
US-12509426-B1 Carbon-14 radioisotope-labeled flonicamid and synthesis method thereof TMEM14C, RPL14, FOS ALDH1A1 2800/4885TSHR 177/4885TRPA1 1737/4885
US-20020095042-A1 Process for brominating the side chain of 4-methylbiphenyl derivatives substituted in the 2' position CBR1, CBR3, RCOR1 ALDH1A1 1734/4885TSHR 411/4885TRPA1 3788/4885
US-12304917-B1 Pleuromutilin derivative containing a thiazolo[5,4-c]pyridine side chain, and a preparation method and application thereof PLEC, MLN, MRPL21 ALDH1A1 1092/4885TSHR 539/4885TRPA1 2341/4885

“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.