SCHEMBL7299339

SCHEMBL7299339

Cc1c(C)c([O])c2ccccc2c1C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 4/20 0.39
TSHR P16473 4/20 0.37
HPGD P15428 3/20 0.37
HSD17B10 Q99714 3/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
CYP3A4 P08684 2/20 0.37
CASP1 P29466 2/20 0.37
CASP7 P55210 2/20 0.37
MAPK1 P28482 2/20 0.37
RAB9A P51151 1/20 0.37
ATM Q13315 1/20 0.37
HIF1A Q16665 1/20 0.37
KDM4E B2RXH2 4/20 0.36
CYP2A6 P11509 3/20 0.36
NPC1 O15118 1/20 0.36
HSP90AA1 P07900 1/20 0.36
GPR3 P46089 1/20 0.35
AHR P35869 1/20 0.34
ALDH1A1 P00352 3/20 0.33
MAOA P21397 2/20 0.33

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
SCHEMBL29660297 0.83 CYP1A2 (0.53) CYP1A2TSHRHPGDHSD17B10L3MBTL1
SCHEMBL357443 0.83 CYP1A2 (0.53) CYP1A2TSHRHPGDHSD17B10L3MBTL1
SCHEMBL28539881 0.80 CYP1A2 (0.50) CYP1A2TSHRHPGDHSD17B10L3MBTL1
Ammonia Solution, Strong SCHEMBL2263911 0.80 CYP1A2 (0.50) CYP1A2TSHRHPGDHSD17B10L3MBTL1
Hydrazine SCHEMBL394386 0.77 CYP1A2 (0.47) CYP1A2TSHRHPGDHSD17B10L3MBTL1
SCHEMBL167933 0.76 CYP1A2 (0.53) CYP1A2TSHRHPGDHSD17B10L3MBTL1
SCHEMBL11038752 0.74 CYP1A2 (0.39) CYP1A2TSHRHPGDHSD17B10L3MBTL1
SCHEMBL377040 0.73 CYP1A2 (0.56) CYP1A2TSHRHPGDHSD17B10L3MBTL1
SCHEMBL29379467 0.73 CYP1A2 (0.56) CYP1A2TSHRHPGDHSD17B10L3MBTL1
Anthraquinone SCHEMBL1376042 0.73 ALDH1A1 (0.41) CYP1A2TSHRHPGDHSD17B10CYP3A4

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240125678-A1 COMPOUND, CELLULAR VESICLE STAIN, AND METHOD FOR FLUORESCENT STAINING OF CELLULAR VESICLES NATIONAL UNIVERSITY CORPORATION TOKAI NATIONAL HIGHER EDUCATION AND RESEARCH SYSTEM (JP) 2024-04-18 US disclosed
WO-2024053316-A1 COMPOUND, EXTRACELLULAR VESICLE STAINING AGENT, AND FLUORESCENT STAINING METHOD FOR EXTRACELLULAR VESICLES 国立大学法人東海国立大学機構 2024-03-14 WO disclosed
EP-4286388-A1 COMPOUND, CELLULAR VESICLE STAIN, AND METHOD FOR FLUORESCENT STAINING OF CELLULAR VESICLES National University Corporation Tokai National Higher Education and Research System (JP) 2023-12-06 EP disclosed
CN-116745272-A Compound, cell vesicle staining agent, and method for fluorescent staining of cell vesicles 国立大学法人东海国立大学机构 2023-09-12 CN disclosed
US-5629406-A AMINO ACID DERIVATIVES SANKYO COMPANY, LIMITED (JP) 1997-05-13 US disclosed
EP-0587311-A1 Peptides capable of inhibiting the activity of HIV protease, their preparation and their therapeutic use SANKYO COMPANY LIMITED (JP) 1994-03-16 EP disclosed
US-4701565-A REACTING ALCOHOL WITH ORGANIC SULFONYL HALIDE TO FORM SULFONATE, REACTING SULFONATE WITH A PHENOL FUJI PHOTO FILM CO., LTD. (JP) 1987-10-20 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 (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-20240125678-A1 COMPOUND, CELLULAR VESICLE STAIN, AND METHOD FOR FLUORESCENT STAINING OF CELLULAR VESICLES EXOSC4, EXOSC5, EXOSC9 CYP1A2 3942/4885TSHR 3500/4885HPGD 4216/4885

“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.