SCHEMBL6959591

SCHEMBL6959591

Cc1ccc([N+](=O)[O-])c(C)c1C=O

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 8/20 0.50
SMN1; SMN2 Q16637 3/20 0.50
TDP1 Q9NUW8 2/20 0.50
HSD17B10 Q99714 1/20 0.44
CYP3A4 P08684 2/20 0.43
ALDH1A1 P00352 2/20 0.43
RECQL P46063 1/20 0.43
KMT2A Q03164 2/20 0.42
MAPT P10636 2/20 0.41
MEN1 O00255 1/20 0.40
CYP1A2 P05177 1/20 0.39
KDM4E B2RXH2 1/20 0.38
LMNA P02545 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
ALDH5A1 P51649 1/20 0.37
ABAT P80404 1/20 0.37
ERN1 O75460 1/20 0.37

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
SCHEMBL10755226 0.85 TSHR (0.50) TSHRSMN1; SMN2TDP1HSD17B10CYP3A4
SCHEMBL15776847 0.81 TDP1 (0.47) TSHRSMN1; SMN2TDP1HSD17B10CYP3A4
SCHEMBL11678862 0.81 HSD17B10 (0.41) TSHRSMN1; SMN2TDP1HSD17B10CYP3A4
SCHEMBL30937734 0.78 HSD17B10 (0.41) TSHRSMN1; SMN2TDP1HSD17B10CYP3A4
SCHEMBL14159967 0.78 TDP1 (0.44) TSHRSMN1; SMN2TDP1HSD17B10CYP3A4
SCHEMBL6973758 0.78 CYP1A2 (0.47) TSHRSMN1; SMN2TDP1HSD17B10CYP3A4
SCHEMBL3192674 0.77 TSHR (0.65) TSHRSMN1; SMN2TDP1HSD17B10CYP3A4
SCHEMBL700297 0.77 TSHR (0.60) TSHRSMN1; SMN2TDP1HSD17B10ALDH1A1
SCHEMBL16975425 0.76 MAPT (0.50) TSHRSMN1; SMN2TDP1ALDH1A1KMT2A
SCHEMBL16975422 0.76 MAPT (0.50) TSHRSMN1; SMN2TDP1ALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250353874-A1 GLUCOCORTICOID RECEPTOR AGONISTS LILLY CO ELI (US) 2025-11-20 US disclosed
US-12404298-B2 Glucocorticoid receptor agonists ELI LILLY AND COMPANY (US) 2025-09-02 US disclosed
EP-4314005-A1 GLUCOCORTICOID RECEPTOR AGONISTS Eli Lilly and Company (US) 2024-02-07 EP disclosed
US-20240018182-A1 GLUCOCORTICOID RECEPTOR AGONISTS ELI LILLY AND COMPANY 2024-01-18 US disclosed
CN-117043172-A Glucocorticoid receptor agonists 伊莱利利公司 2023-11-10 CN disclosed
US-11787834-B2 Glucocorticoid receptor agonists ELI LILLY AND COMPANY (US) 2023-10-17 US disclosed
US-20220324904-A1 GLUCOCORTICOID RECEPTOR AGONISTS ELI LILLY AND COMPANY 2022-10-13 US disclosed
WO-2022204108-A1 GLUCOCORTICOID RECEPTOR AGONISTS ELI LILLY AND COMPANY (US) 2022-09-29 WO disclosed
CN-106132406-B β -substituted gamma-amino acids and analogs as chemotherapeutic agents 夸德里加生物科学公司 2020-03-27 CN disclosed
US-9937139-B2 β-substituted γ-amino acids and analogs as chemotherapeutic agents QUADRIGA BIOSCIENCES, INC. (US) 2018-04-10 US disclosed
US-20150218085-A1 BETA-SUBSTITUTED GAMMA-AMINO ACIDS AND ANALOGS AS CHEMOTHERAPEUTIC AGENTS QUADRIGA BIOSCIENCES, INC. 2015-08-06 US disclosed
US-20150218085-A1 BETA-SUBSTITUTED GAMMA-AMINO ACIDS AND ANALOGS AS CHEMOTHERAPEUTIC AGENTS QUADRIGA BIOSCIENCES, INC. 2015-08-06 US disclosed
WO-2015117146-A1 BETA-SUBSTITUTED GAMMA-AMINO ACIDS AND ANALOGS AS CHEMOTHERAPEUTIC AGENTS QUADRIGA BIOSCIENCES, INC. (US) 2015-08-06 WO disclosed
WO-2015117146-A1 BETA-SUBSTITUTED GAMMA-AMINO ACIDS AND ANALOGS AS CHEMOTHERAPEUTIC AGENTS QUADRIGA BIOSCIENCES, INC. (US) 2015-08-06 WO disclosed
CN-1145623-C Imidazole derivatives - 2004-04-14 CN disclosed
EP-0797575-B1 IMIDAZOLE DERIVATIVES AS PROTEIN KINASE INHIBITORS IN PARTICULAR EGF-R TYROSINE KINASE HOFFMANN LA ROCHE (CH) 2003-10-15 EP disclosed
US-5959113-A REACTING A DIKETONE DERIVATIVE WITH AN ALDEHYDE DERIVATIVE; ADMINISTERING TO TREAT ATHEROSCLEROSIS, PSORIASIS, ALOPECIA AND TUMORS HOFFMANN-LA ROCHE INC. (US) 1999-09-28 US disclosed
CN-1175252-A Imidazole derivatives as protein kinase inhibitors in particular egf-rthyrosine kinase HOFFMANN LA ROCHE (CH) 1998-03-04 CN disclosed
EP-0797575-A1 IMIDAZOLE DERIVATIVES AS PROTEIN KINASE INHIBITORS IN PARTICULAR EGF-R TYROSINE KINASE F. HOFFMANN-LA ROCHE AG (CH) 1997-10-01 EP disclosed
WO-1996018626-A1 IMIDAZOLE DERIVATIVES AS PROTEIN KINASE INHIBITORS IN PARTICULAR EGF-R TYROSINE KINASE F. HOFFMANN-LA ROCHE AG (CH) 1996-06-20 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 (6 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-12404298-B2 Glucocorticoid receptor agonists NR3C1, NR3C2, MC2R TSHR 193/4885SMN1; SMN2 4255/4885TDP1 4018/4885
US-20240018182-A1 GLUCOCORTICOID RECEPTOR AGONISTS NR3C1, NR3C2, MC2R TSHR 193/4885SMN1; SMN2 4255/4885TDP1 4018/4885
US-20250353874-A1 GLUCOCORTICOID RECEPTOR AGONISTS NR3C1, NR3C2, MC2R TSHR 193/4885SMN1; SMN2 4255/4885TDP1 4018/4885
US-11787834-B2 Glucocorticoid receptor agonists NR3C1, NR3C2, MC2R TSHR 193/4885SMN1; SMN2 4255/4885TDP1 4018/4885
US-20220324904-A1 GLUCOCORTICOID RECEPTOR AGONISTS NR3C1, NR3C2, MC2R TSHR 193/4885SMN1; SMN2 4255/4885TDP1 4018/4885
US-20150218085-A1 BETA-SUBSTITUTED GAMMA-AMINO ACIDS AND ANALOGS AS CHEMOTHERAPEUTIC AGENTS SLC3A2, SLC7A1, SLC43A1 TSHR 3050/4885SMN1; SMN2 2078/4885TDP1 2642/4885

“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.