SCHEMBL26086739

SCHEMBL26086739

Cn1c2c(cc(C(=O)Nc3ncc(F)cn3)c1=O)C(C)(C)CC2

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AHR P35869 9/20 0.43
▸ NLRP3 Q96P20 2/20 0.35
▸ RARA P10276 1/20 0.34
▸ RARG P13631 1/20 0.34
▸ INSR P06213 3/20 0.33
▸ MET P08581 3/20 0.33
▸ USP2 O75604 2/20 0.33
▸ HSD17B10 Q99714 2/20 0.33
▸ MAPT P10636 2/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ PKM P14618 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ PTPN11 Q06124 1/20 0.33
▸ TSHR P16473 1/20 0.32
▸ CXCR2 P25025 1/20 0.32
▸ LMNA P02545 1/20 0.32

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
SCHEMBL26089593 0.88 AHR (0.39) AHRNLRP3RARARARGUSP2
SCHEMBL26089073 0.77 ALDH1A1 (0.41) AHRNLRP3USP2HSD17B10MAPT
SCHEMBL26089047 0.76 AHR (0.70) AHRNLRP3MAPTLMNA
SCHEMBL26086751 0.76 AHR (0.70) AHRNLRP3MAPTLMNA
SCHEMBL26087025 0.76 AHR (0.70) AHRNLRP3MAPTLMNA
SCHEMBL26419139 0.74 AHR (0.54) AHRNLRP3METMAPTLMNA
SCHEMBL26419127 0.74 AHR (0.54) AHRNLRP3METMAPTLMNA
SCHEMBL26086929 0.74 AHR (0.54) AHRNLRP3METMAPTLMNA
SCHEMBL26419367 0.74 AHR (0.53) AHRNLRP3MAPTLMNA
SCHEMBL26089343 0.74 AHR (0.53) AHRNLRP3MAPTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12037322-B2 AHR agonists ELI LILLY AND COMPANY (US) 2024-07-16 — — US disclosed
US-12037322-B2 AHR agonists ELI LILLY AND COMPANY (US) 2024-07-16 — — US disclosed
US-12037322-B2 AHR agonists ELI LILLY AND COMPANY (US) 2024-07-16 — — US disclosed
US-20230127797-A1 AHR AGONISTS ELI LILLY AND COMPANY 2023-04-27 — — US disclosed
US-20230127797-A1 AHR AGONISTS ELI LILLY AND COMPANY 2023-04-27 — — US disclosed
US-20230127797-A1 AHR AGONISTS ELI LILLY AND COMPANY 2023-04-27 — — 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 (2 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-12037322-B2 AHR agonists AHR, ARNT, RORC AHR 1/4885NLRP3 146/4885RARA 490/4885
US-20230127797-A1 AHR AGONISTS AHR, ARNT, RORC AHR 1/4885NLRP3 146/4885RARA 490/4885

“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.

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