SCHEMBL192166

SCHEMBL192166

Brc1ccc2cc(Br)ccc2c1

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 3/20 0.77
ALDH1A1 P00352 2/20 0.68
KDM4E B2RXH2 1/20 0.68
MEN1 O00255 1/20 0.68
MAPT P10636 1/20 0.68
KMT2A Q03164 1/20 0.68
BACE1 P56817 2/20 0.50
AHR P35869 3/20 0.48
NR4A2 P43354 1/20 0.48
CYP11B1 P15538 1/20 0.46
CYP11B2 P19099 1/20 0.46
NCEH1 Q6PIU2 1/20 0.45
NOS1 P29475 2/20 0.44
METAP2 P50579 2/20 0.44
CYP1A2 P05177 1/20 0.44
CYP2C19 P33261 1/20 0.44
HTT P42858 1/20 0.44
CSNK2A1 P68400 1/20 0.44
DYRK1A Q13627 1/20 0.44
ALOX15 P16050 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
SCHEMBL29353067 1.00 CYP2A6 (0.77) CYP2A6ALDH1A1KDM4EMEN1MAPT
SCHEMBL17849092 0.93 CYP2A6 (0.68) CYP2A6ALDH1A1KDM4EMEN1MAPT
SCHEMBL29427549 0.93 CYP2A6 (0.68) CYP2A6ALDH1A1KDM4EMEN1MAPT
SCHEMBL148642 0.93 CYP2A6 (0.68) CYP2A6ALDH1A1KDM4EMEN1MAPT
SCHEMBL13153611 0.93 CYP2A6 (0.68) CYP2A6ALDH1A1KDM4EMEN1MAPT
SCHEMBL23312077 0.93 CYP2A6 (0.68) CYP2A6ALDH1A1KDM4EMEN1MAPT
SCHEMBL17849089 0.93 CYP2A6 (0.68) CYP2A6ALDH1A1KDM4EMEN1MAPT
SCHEMBL29371678 0.89 CYP2A6 (0.72) CYP2A6ALDH1A1KDM4EMEN1MAPT
SCHEMBL2051640 0.89 CYP2A6 (0.72) CYP2A6ALDH1A1KDM4EMEN1MAPT
SCHEMBL9566139 0.87 CYP2A6 (0.62) CYP2A6ALDH1A1KDM4EMEN1MAPT

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 1142 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117946154-A Organic silicon resin monomer containing large steric hindrance functional group, preparation method thereof and application of high-temperature-resistant material 哈尔滨工业大学 2024-04-30 CN claimed
CN-115322228-B Binuclear nitrogen heterocyclic carbene ruthenium complex and preparation method and application thereof 武汉理工大学 2024-02-13 CN claimed
CN-117402494-A Complex high-strength polyarylene sulfide based composite material and preparation and application thereof 新凝合科技(成都)有限公司 2024-01-16 CN claimed
CN-116813834-B Flexible stretchable organic room-temperature phosphorescent material and preparation method thereof 南京邮电大学 2023-11-14 CN claimed
CN-116813834-A Flexible stretchable organic room-temperature phosphorescent material and preparation method thereof 南京邮电大学 2023-09-29 CN claimed
US-11527407-B2 Vapor deposition of carbon-based films APPLIED MATERIALS, INC. (US) 2022-12-13 US claimed
CN-115322228-A Binuclear nitrogen heterocyclic carbene ruthenium complex and preparation method and application thereof 武汉理工大学 2022-11-11 CN claimed
CN-114539472-A Organic room temperature phosphorescent polymer, preparation thereof and application thereof in X-ray imaging 南京邮电大学 2022-05-27 CN claimed
CN-109851701-B Dinuclear metallocene catalyst and preparation method and application thereof 万华化学集团股份有限公司 2021-12-14 CN claimed
US-20210280420-A1 Vapor Deposition Of Carbon-Based Films APPLIED MATERIALS, INC. (US) 2021-09-09 US claimed
CN-102660000-B Conjugated polyelectrolyte with ratiometric fluorescence signals, preparation method and application thereof UNIV HUNAN NORMAL 2014-09-24 CN claimed
CN-104031087-A Alcohol-soluble cathode buffer layer organic molecular material as well as preparation method and application of material UNIV SOUTH CHINA TECH 2014-09-10 CN claimed
CN-102660000-A Conjugated polyelectrolyte with ratiometric fluorescence signals, preparation method and application thereof UNIV HUNAN NORMAL 2012-09-12 CN claimed
CN-1990477-A Linear dicationic terphenyls and their aza analogues as antiparasitic agents UNIV NORTH CAROLINA CHAPEL HILL (US) 2007-07-04 CN claimed
US-20060293328-A1 Linear dicationic terphenyls and their aza analogues as antiparasitic agents TIDWELL RICHARD R 2006-12-28 US claimed
EP-1736466-A1 Linear dicationic terphenyls and their aza analogues as antiparasitic agents The University of North Carolina at Chapel Hill (US) 2006-12-27 EP claimed
EP-0530707-A1 Method for preparing polyamide-imides EASTMAN KODAK COMPANY (US) 1993-03-10 EP claimed
EP-0530705-A1 Method for producing polyamide-imides EASTMAN KODAK COMPANY (US) 1993-03-10 EP claimed
EP-0530703-A2 Method for the preparation of polyamide-imides EASTMAN KODAK COMPANY (US) 1993-03-10 EP claimed
US-4845280-A CATALYTIC CARBONYLATION OF AROMATIC BROMIDES EASTMAN KODAK COMPANY (US) 1989-07-04 US 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 (1 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-20060293328-A1 Linear dicationic terphenyls and their aza analogues as antiparasitic agents TPMT, TYMS, DDT CYP2A6 869/4885ALDH1A1 2647/4885KDM4E 719/4885

“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.