SCHEMBL3520052

SCHEMBL3520052

O=C(O)C1COc2ccccc2C1=O

nearest known ligand 0.58

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 14/20 0.58
MAOB P27338 2/20 0.54
SIGMAR1 Q99720 2/20 0.45
PKM P14618 1/20 0.43
TSHR P16473 1/20 0.43
HTR1A P08908 1/20 0.42

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
SCHEMBL11635929 0.85 CYP19A1 (0.53) CYP19A1MAOBSIGMAR1PKMTSHR
SCHEMBL15603238 0.83 CYP19A1 (0.47) CYP19A1MAOBSIGMAR1PKMTSHR
Fluoride SCHEMBL11424190 0.82 CYP19A1 (0.50) CYP19A1MAOBSIGMAR1PKMTSHR
SCHEMBL8470409 0.81 CYP19A1 (0.49) CYP19A1MAOBSIGMAR1PKMTSHR
SCHEMBL11638586 0.81 MAOB (0.49) CYP19A1MAOBSIGMAR1TSHRHTR1A
SCHEMBL11424192 0.80 CYP19A1 (0.48) CYP19A1MAOBSIGMAR1PKMTSHR
SCHEMBL9832882 0.79 MAOB (0.47) CYP19A1MAOBSIGMAR1HTR1A
SCHEMBL1990181 0.77 ALDH1A1 (0.50) CYP19A1MAOB
SCHEMBL7840882 0.77 CYP19A1 (0.46) CYP19A1MAOBSIGMAR1PKMTSHR
SCHEMBL2794624 0.77 GLS (0.47)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11874601-B2 Resist composition, method of forming resist pattern, compound, and acid diffusion-controlling agent TOKYO OHKA KOGYO CO., LTD. (JP) 2024-01-16 US disclosed
US-11874601-B2 Resist composition, method of forming resist pattern, compound, and acid diffusion-controlling agent TOKYO OHKA KOGYO CO., LTD. (JP) 2024-01-16 US disclosed
US-20220011665-A1 RESIST COMPOSITION, METHOD OF FORMING RESIST PATTERN, COMPOUND, AND ACID DIFFUSION-CONTROLLING AGENT TOKYO OHKA KOGYO CO., LTD. (JP) 2022-01-13 US disclosed
US-7667053-B2 Cannabinoid-1 (CB1) receptor antagonists and/or inverse agonists; e.g. N-(2,3-bis(4-chlorophenyl)-1-methylpropyl)-1,4-benzodioxane-2-carboxamide; psychological disorders, eating disorders MERCK & CO., INC. (US) 2010-02-23 US disclosed
EP-1499306-A4 BICYCLIC AMIDES MERCK & CO INC (US) 2007-03-28 EP disclosed
US-20050203112-A1 Bicyclic amides MERCK SHARP & DOHME CORP. 2005-09-15 US disclosed
EP-1499306-A2 BICYCLIC AMIDES Merck & Co., Inc. (US) 2005-01-26 EP disclosed
WO-2003086288-A2 BICYCLIC AMIDES MERCK & CO., INC. (US) 2003-10-23 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 (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-20220011665-A1 RESIST COMPOSITION, METHOD OF FORMING RESIST PATTERN, COMPOUND, AND ACID DIFFUSION-CONTROLLING AGENT MRPS23, MRPS22, SLC11A2 CYP19A1 3468/4885MAOB 4053/4885SIGMAR1 348/4885
US-20050203112-A1 Bicyclic amides CNR1, CNR2, FAAH CYP19A1 1296/4885MAOB 550/4885SIGMAR1 750/4885
US-11874601-B2 Resist composition, method of forming resist pattern, compound, and acid diffusion-controlling agent MRPS23, MRPS22, SLC11A2 CYP19A1 3464/4885MAOB 4031/4885SIGMAR1 368/4885

“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.