SCHEMBL26086625

SCHEMBL26086625

CC1CCc2c1cc(C(=O)NC1CCCC1)c(=O)n2C

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ AHR P35869 5/20 0.58
▸ CNR2 P34972 6/20 0.48
▸ CNR1 P21554 5/20 0.48
▸ ALDH1A1 P00352 6/20 0.44
▸ MEN1 O00255 1/20 0.43
▸ CYP1A2 P05177 1/20 0.43
▸ CYP2C19 P33261 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ GAA P10253 1/20 0.42
▸ NPC1 O15118 2/20 0.41
▸ RAB9A P51151 2/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ HPGD P15428 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ TSHR P16473 1/20 0.40

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
SCHEMBL26419333 1.00 AHR (0.58) AHRCNR2CNR1ALDH1A1MEN1
SCHEMBL26419335 1.00 AHR (0.58) AHRCNR2CNR1ALDH1A1MEN1
SCHEMBL26088845 0.80 AHR (0.57) AHRALDH1A1CYP1A2KMT2AGAA
SCHEMBL26088960 0.80 AHR (0.57) AHRALDH1A1CYP1A2KMT2AGAA
SCHEMBL26419165 0.80 AHR (0.57) AHRALDH1A1CYP1A2KMT2AGAA
SCHEMBL26088751 0.79 AHR (0.55) AHRALDH1A1KDM4EHPGD
SCHEMBL26087999 0.78 AHR (0.87) AHRALDH1A1MEN1KMT2ARAB9A
SCHEMBL26086663 0.78 AHR (0.87) AHRALDH1A1MEN1KMT2ARAB9A
SCHEMBL26089594 0.78 AHR (0.87) AHRALDH1A1MEN1KMT2ARAB9A
SCHEMBL26086722 0.75 AHR (0.68) AHRALDH1A1KMT2AGAANPC1

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 1/4885CNR2 80/4885CNR1 89/4885
US-20230127797-A1 AHR AGONISTS AHR, ARNT, RORC AHR 1/4885CNR2 80/4885CNR1 89/4885

“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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