SCHEMBL25025740

SCHEMBL25025740

OCCc1cnc(N2CCN(CC(F)(F)F)CC2)c(F)c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SCN10A Q9Y5Y9 1/20 0.37
▸ ABL1 P00519 1/20 0.36
▸ ALDH1A1 P00352 4/20 0.35
▸ SMN1; SMN2 Q16637 4/20 0.35
▸ MEN1 O00255 3/20 0.35
▸ KMT2A Q03164 3/20 0.35
▸ MAPT P10636 1/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.35
▸ LMNA P02545 2/20 0.33
▸ POLB P06746 2/20 0.33
▸ TSHR P16473 1/20 0.32
▸ HTT P42858 1/20 0.32
▸ EP300 Q09472 1/20 0.32
▸ NR1H2 P55055 1/20 0.32
▸ NR1H3 Q13133 1/20 0.32
▸ LCAT P04180 1/20 0.32
▸ ROCK2 O75116 1/20 0.31
▸ ROCK1 Q13464 1/20 0.31
▸ HSD11B1 P28845 1/20 0.31
▸ DRD2 P14416 1/20 0.31

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
SCHEMBL25553737 0.84 HTT (0.42) ALDH1A1SMN1; SMN2MEN1KMT2AMAPT
SCHEMBL20124474 0.81 SMN1; SMN2 (0.44) SMN1; SMN2MEN1KMT2AMAPTTSHR
SCHEMBL24215714 0.79 SCN10A (0.37) SCN10AABL1ALDH1A1SMN1; SMN2MEN1
SCHEMBL18902116 0.79 TAAR1 (0.38) MAPTLMNA
SCHEMBL23622940 0.79 SCN10A (0.39) SCN10AABL1ALDH1A1SMN1; SMN2MEN1
SCHEMBL18902056 0.78 KDM4E (0.35) ALDH1A1MAPTLMNATSHRCACNA1H
SCHEMBL25025841 0.77 TRPV3 (0.37) SCN10ACACNA1H
SCHEMBL30233815 0.77 TRPV3 (0.37) SCN10ACACNA1H
SCHEMBL24215432 0.77 ABL1 (0.42) SCN10AABL1ALDH1A1SMN1; SMN2MEN1
SCHEMBL30412622 0.71 SCN10A (0.36) SCN10AABL1ALDH1A1SMN1; SMN2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230167057-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY NOVARTIS PHARMA AG (CH) 2023-06-01 — — US disclosed
WO-2023018781-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY IFM DUE, INC. (US) 2023-02-16 — — 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 (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-20230167057-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY STING1, CGAS, IRF3 SCN10A 2166/4885ABL1 1538/4885ALDH1A1 4654/4885

“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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