SCHEMBL24225606

SCHEMBL24225606

CC(C)C(C)(C)Oc1ccc(F)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.37
▸ NFE2L2 Q16236 1/20 0.36
▸ GAA P10253 1/20 0.35
▸ CASR P41180 1/20 0.35
▸ CNR1 P21554 2/20 0.35
▸ ACHE P22303 1/20 0.33
▸ HSD11B1 P28845 1/20 0.33
▸ L3MBTL1 Q9Y468 2/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ POLB P06746 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ PDE2A O00408 1/20 0.33
▸ NPC1 O15118 1/20 0.32
▸ RAB9A P51151 1/20 0.32
▸ MAOA P21397 1/20 0.32
▸ MAOB P27338 1/20 0.32
▸ CYP1A2 P05177 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
SCHEMBL17299692 0.78 PPARA (0.50) ALDH1A1CNR1ACHEMEN1POLB
SCHEMBL22548143 0.78 GAA (0.39) ALDH1A1NFE2L2GAACASRACHE
SCHEMBL17877182 0.77 MAPK1 (0.41) ALDH1A1L3MBTL1KDM4EMAPK1MAOA
SCHEMBL4977051 0.77 NFE2L2 (0.41) ALDH1A1NFE2L2GAACASRACHE
SCHEMBL19477799 0.75 GAA (0.42) ALDH1A1NFE2L2GAACASRACHE
SCHEMBL18016869 0.74 CASR (0.35) ALDH1A1NFE2L2GAACASRCNR1
SCHEMBL11611825 0.74 CASR (0.39) ALDH1A1GAACASRCNR1KDM4E
SCHEMBL11518124 0.74 CASR (0.36) ALDH1A1NFE2L2GAACASRCNR1
SCHEMBL11665566 0.74 NFE2L2 (0.34) ALDH1A1NFE2L2GAACASRCNR1
SCHEMBL3160868 0.73 NFE2L2 (0.39) ALDH1A1NFE2L2GAACASRCNR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220024906-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY NOVARTIS PHARMA AG (CH) 2022-01-27 — — 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 (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-20220024906-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY STING1, CGAS, IRF3 ALDH1A1 4654/4885NFE2L2 606/4885GAA 184/4885

“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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